Crystallography Open Database

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4036254 CIFC11 H14 O3P 15.8748; 6.6516; 7.3831
67.621; 84.526; 66.767
244.64Mostinski, Yelena; Valerio, Viviana; Lankri, David; Tsvelikhovsky, Dmitry
Synthesis of Tricyclic Spiranoid Lactones via I2/Sm(II)- and I2/Pd(0)-Mediated Cyclizations of a Common Cycloalkylmethylene Precursor.
The Journal of organic chemistry, 2015, 80, 10464-10473
4036211 CIFC14 H22 O8P 16.098; 7.378; 9.239
106.18; 100.896; 96.42
386Blade, Helen; Bradley, Derek; Diorazio, Louis; Evans, Timothy; Hayter, Barry R.; Howell, Gareth P.
Modular Synthesis of Constrained Ethyl (cEt) Purine and Pyrimidine Nucleosides.
The Journal of organic chemistry, 2015, 80, 5337-5343
4031018 CIFC9 H15 N O2P 1 21 15.5907; 13.518; 5.7882
90; 92.261; 90
437.1Si, Chang-Mei; Mao, Zhuo-Ya; Dong, Han-Qing; Du, Zhen-Ting; Wei, Bang-Guo; Lin, Guo-Qiang
Divergent Method to trans-5-Hydroxy-6-alkynyl/alkenyl-2-piperidinones: Syntheses of (-)-Epiquinamide and (+)-Swainsonine.
The Journal of organic chemistry, 2015, 80, 5824-5833
4031127 CIFC22 H19 N O SeP 16.9162; 7.8388; 9.2345
103.149; 106.046; 99.634
454.13Murai, Toshiaki; Mizutani, Tomohiko; Ebihara, Masahiro; Maruyama, Toshifumi
α-Hydroxy and α-Oxo Selenoamides: Synthesis via Nucleophilic Selenocarbamoylation of Carbonyl Compounds and Characterization.
The Journal of organic chemistry, 2015, 80, 6903-6907
4031293 CIFC7 H9 Cl N4 O2P -16.0855; 7.9433; 10.3049
99.743; 106.984; 100.825
454.42Lee, Mijoon; Rucil, Tomas; Hesek, Dusan; Oliver, Allen G.; Fisher, Jed F.; Mobashery, Shahriar
Regioselective Control of the SNAr Amination of 5-Substituted-2,4-Dichloropyrimidines Using Tertiary Amine Nucleophiles.
The Journal of organic chemistry, 2015, 80, 7757-7763
4030583 CIFC11 H12 N2 O2P -16.9967; 8.5345; 9.7334
110.752; 94.833; 106.902
508.51Guthrie, Daryl A.; Ho, Anthony; Takahashi, Cyrus G.; Collins, Anthony; Morris, Matthew; Toscano, John P.
"Catch-and-Release" of HNO with Pyrazolones.
The Journal of organic chemistry, 2015, 80, 1338-1348
4031295 CIFC9 H11 Cl N4P -16.9943; 7.3867; 10.468
97.082; 106.868; 92.782
511.58Lee, Mijoon; Rucil, Tomas; Hesek, Dusan; Oliver, Allen G.; Fisher, Jed F.; Mobashery, Shahriar
Regioselective Control of the SNAr Amination of 5-Substituted-2,4-Dichloropyrimidines Using Tertiary Amine Nucleophiles.
The Journal of organic chemistry, 2015, 80, 7757-7763
4030321 CIFC10 H13 N O2 SP 1 21 16.4713; 6.9416; 11.6404
90; 101.765; 90
511.92Fauber, Benjamin P.; Clagg, Kyle; Gibbons, Paul; Rene, Olivier
An Experimental and Computational Study of the Diastereoselective Alkylations of 3-Substituted gamma-Sultams.
The Journal of organic chemistry, 2014, 80, 685
4030314 CIFC12 H10 O4P -17.5873; 8.0869; 10.0489
102.73; 96.588; 117.756
515.07Zhang, Mingliang; Zhang, Hui-Jun; Han, Tiantian; Ruan, Wenqing; Wen, Ting-Bin
Rh(III)-Catalyzed Oxidative Coupling of Benzoic Acids with Geminal-Substituted Vinyl Acetates: Synthesis of 3-Substituted Isocoumarins.
The Journal of organic chemistry, 2014, 80, 620
4036290 CIFC11 H14 N2 O2P 1 21 15.3134; 8.1507; 12.0605
90; 93.485; 90
521.35Conde, Egoitz; Rivilla, Iván; Larumbe, Amaia; Cossío, Fernando P
Enantiodivergent Synthesis of Bis-Spiropyrrolidines via Sequential Interrupted and Completed (3 + 2) Cycloadditions.
The Journal of organic chemistry, 2015, 80, 11755-11767
4030979 CIFC12 H8 I N3P -17.4374; 8.7655; 9.8437
113.251; 92.4; 111.062
537.44Postnikov, Pavel S.; Guselnikova, Olga A.; Yusubov, Mekhman S.; Yoshimura, Akira; Nemykin, Victor N.; Zhdankin, Viktor V.
Preparation and X-ray Structural Study of Dibenziodolium Derivatives.
The Journal of organic chemistry, 2015, 80, 5783-5788
4036310 CIFC12 H14 N2 O2P -17.7458; 8.3388; 9.2703
77.293; 68.194; 84.734
542.28Chaiyaveij, Duangduan; Batsanov, Andrei S.; Fox, Mark A.; Marder, Todd B.; Whiting, Andrew
An Experimental and Computational Approach to Understanding the Reactions of Acyl Nitroso Compounds in [4 + 2] Cycloadditions.
The Journal of organic chemistry, 2015, 80, 9518-9534
4030768 CIFC13 H15 N OP 1 21 18.1102; 5.2791; 13.309
90; 105.678; 90
548.62Silva, Saúl; Rodrigues, Paula; Bento, Isabel; Maycock, Christopher D.
The aza-wharton reaction: syntheses of cyclic allylic amines and vicinal hydroxyamines from the respective acylaziridines.
The Journal of organic chemistry, 2015, 80, 3067-3074
4036256 CIFC13 H18 O2P -16.706; 7.429; 11.243
95.326; 93.482; 92.823
555.82Mostinski, Yelena; Valerio, Viviana; Lankri, David; Tsvelikhovsky, Dmitry
Synthesis of Tricyclic Spiranoid Lactones via I2/Sm(II)- and I2/Pd(0)-Mediated Cyclizations of a Common Cycloalkylmethylene Precursor.
The Journal of organic chemistry, 2015, 80, 10464-10473
4030892 CIFC15 H11 N OP -13.882; 12.069; 12.451
106.586; 94.219; 90.27
557.4Mayo, Muhammad Shareef; Yu, Xiaoqiang; Feng, Xiujuan; Yamamoto, Yoshinori; Bao, Ming
Isoquinolone Synthesis through SNAr Reaction of 2-Halobenzonitriles with Ketones Followed by Cyclization.
The Journal of organic chemistry, 2015, 80, 3998-4002
4036474 CIFC17 H11 NP 1 21/n 17.1014; 4.5936; 17.649
90; 98.661; 90
569.16Han, Wenyong; Zhou, Xiaojian; Yang, Siyi; Xiang, Guangyan; Cui, Baodong; Chen, Yongzheng
Palladium-Catalyzed Nucleophilic Substitution/C-H Activation/Aromatization Cascade Reaction: One Approach To Construct 6-Unsubstituted Phenanthridines.
The Journal of organic chemistry, 2015, 80, 11580-11587
4030611 CIFC11 H13 F N2 O5P -17.235; 7.7188; 10.6228
92.941; 94.611; 102.675
575.45Clarkson, Rob; Komsta, Zofia; Mayes, Benjamin A.; Moussa, Adel; Shelbourne, Montserrat; Stewart, Alistair; Tyrrell, Andrew J.; Wallis, Laura L.; Weymouth-Wilson, Alexander C
Synthesis of 2,3-Dideoxy-2-fluoro-2,3-endo-methylene- and 2,3-Dideoxy-2-fluoro-3-C-hydroxymethyl-2,3-endo-methylene-pentofuranoses and Their Use in the Preparation of Conformationally Locked Bicyclic Nucleosides.
The Journal of organic chemistry, 2015, 80, 2198-2215
4036240 CIFC9 H3 B Cl4 F2 N2P -17.6289; 8.1807; 11.2033
68.596; 86.853; 63.378
576.98Zhao, Ning; Xuan, Sunting; Fronczek, Frank R.; Smith, Kevin M.; Vicente, M Graça H
Stepwise Polychlorination of 8-Chloro-BODIPY and Regioselective Functionalization of 2,3,5,6,8-Pentachloro-BODIPY.
The Journal of organic chemistry, 2015, 80, 8377-8383
4030400 CIFC24 H32 N2 O6P 17.2974; 8.3147; 9.969
75.788; 83.489; 89.109
582.53Nocket, Anthony J.; Feng, Yiqing; Weinreb, Steven M.
Construction of the Myrioneuron Alkaloids: A Total Synthesis of (±)-Myrioneurinol.
The Journal of organic chemistry, 2014, 80, 1116
4031290 CIFC11 H15 Cl N4 O2P -15.1161; 9.4299; 13.2397
73.055; 81.356; 89.632
603.6Lee, Mijoon; Rucil, Tomas; Hesek, Dusan; Oliver, Allen G.; Fisher, Jed F.; Mobashery, Shahriar
Regioselective Control of the SNAr Amination of 5-Substituted-2,4-Dichloropyrimidines Using Tertiary Amine Nucleophiles.
The Journal of organic chemistry, 2015, 80, 7757-7763
4036261 CIFC14 H16 O4P 1 c 18.5158; 6.0532; 11.8232
90; 95.954; 90
606.17Chen, Jun; Kilpatrick, Brenden; Oliver, Allen G.; Wulff, Jeremy E.
Expansion of Thiele's Acid Chemistry in Pursuit of a Suite of Conformationally Constrained Scaffolds.
The Journal of organic chemistry, 2015, 80, 8979-8989
4031559 CIFC12 H12 Cl N O3P -16.181; 7.296; 14.295
104.493; 92.4; 101.853
607.9Xing, Linlin; Li, Chunbao
Stereoselective Chlorination and Bromination of Enamides and Enamines via an Electrostatic Attraction Effect Using (1,1-Diacetoxyiodo)benzene and a Halide Source.
The Journal of organic chemistry, 2015, 80, 10000-10008
4031525 CIFC13 H11 Cl N2 O3P -17.5626; 8.2241; 11.3238
92.818; 104.129; 113.802
616.18Provencher, Philip A.; Love, Jennifer A.
Synthesis and Performance of a Biomimetic Indicator for Alkylating Agents.
The Journal of organic chemistry, 2015, 80, 9603-9609
4031736 CIFC24 H26 Br2 Si2P -17.578; 9.1129; 9.9879
114.28; 94.306; 95.903
620.13Gluyas, Josef B. G.; Manici, Valentina; Gückel, Simon; Vincent, Kevin B.; Yufit, Dmitry S.; Howard, Judith A. K.; Skelton, Brian W.; Beeby, Andrew; Kaupp, Martin; Low, Paul J.
Cross-Conjugated Systems Based On An (E)-Hexa-3-en-1,5-diyne-3,4-diyl Skeleton: Spectroscopic and Spectroelectrochemical Investigations.
The Journal of organic chemistry, 2015, 80, 11501-11512
4031329 CIFC11 H7 Br F6 O2P -17.1474; 9.7769; 10.0809
67.2457; 86.5387; 78.9053
637.4Ams, Mark R.; Fields, Michael; Grabnic, Timothy; Janesko, Benjamin G.; Zeller, Matthias; Sheridan, Rose; Shay, Amanda
Unraveling the Role of Alkyl F on CH-π Interactions and Uncovering the Tipping Point for Fluorophobicity.
The Journal of organic chemistry, 2015, 80, 7764-7769
4030612 CIFC11 H17 Br N2 O2P -15.909; 9.42; 12.251
97.002; 92.212; 103.538
656.4Huber, Tatjana; Kaiser, Daniel; Rickmeier, Jens; Magauer, Thomas
Experimental Studies on the Selective β-C-H Halogenation of Enones.
The Journal of organic chemistry, 2015, 80, 2281-2294
4031314 CIFC16 H10 N2 O SP -16.84; 8.619; 11.394
99.62; 92.49; 91.05
661.427Hayes, Colin O.; Bell, William K.; Cassidy, Benjamin R.; Willson, C. Grant
Synthesis and Characterization of a Two Stage, Nonlinear Photobase Generator.
The Journal of organic chemistry, 2015, 80, 7530-7535
4036198 CIFC16 H16 N2 O2P -17.7983; 8.4361; 10.6779
97.918; 106.53; 90.609
666.1Liu, Jianzhong; Xie, Ying; Zeng, Wei; Lin, Dongen; Deng, Yuanfu; Lu, Xiaoxia
Pd(II)-Catalyzed Pyridine N-Oxides Directed Arylation of Unactivated Csp(3)-H Bonds.
The Journal of organic chemistry, 2015, 80, 4618-4626
4036475 CIFC13 H14 Cl N O3P -17.2031; 9.4082; 10.7921
76.882; 77.792; 71.232
666.76Horta, Pedro; Kuş, Nihal; Henriques, Marta Sofia C.; Paixão, José A; Coelho, Lis; Nogueira, Fátima; O'Neill, Paul M; Fausto, Rui; Cristiano, Maria Lurdes Santos
Quinolone-Hydroxyquinoline Tautomerism in Quinolone 3-Esters. Preserving the 4-Oxoquinoline Structure To Retain Antimalarial Activity.
The Journal of organic chemistry, 2015, 80, 12244-12257
4030673 CIFC18 H16 F NP -18.7186; 9.7432; 9.7497
110.309; 99.085; 112.934
672.86Imrich, Hans-Georg; Conrad, Jürgen; Bubrin, Denis; Beifuss, Uwe
From nitrobenzenes to substituted tetrahydroquinolines in a single step by a domino reduction/imine formation/aza-diels-alder reaction.
The Journal of organic chemistry, 2015, 80, 2319-2332
4036120 CIFC17 H16 O2P 1 21 111.449; 4.911; 12.034
90; 95.046; 90
674Meng, Ling; Yang, Wen; Pan, Xuejing; Tao, Meng; Cheng, Guo; Wang, Sanyong; Zeng, Heping; Long, Yuhua; Yang, Dingqiao
Platinum-catalyzed asymmetric ring-opening reactions of oxabenzonorbornadienes with phenols.
The Journal of organic chemistry, 2015, 80, 2503-2512
4031748 CIFC4 H8 Cl F2 N O2P 1 21/c 14.7744; 16.1844; 8.8835
90; 96.455; 90
682.08Kondratov, Ivan S.; Bugera, Maksym Ya; Tolmachova, Nataliya A.; Posternak, Ganna G.; Daniliuc, Constantin G.; Haufe, Günter
Radical Reactions of Alkyl 2-Bromo-2,2-difluoroacetates with Vinyl Ethers: "Omitted" Examples and Application for the Synthesis of 3,3-Difluoro-GABA.
The Journal of organic chemistry, 2015, 80, 12258-12264
4030694 CIFC12 H13 Br F3 N O2 SP -16.9579; 10.516; 10.5474
65.766; 80.838; 77.224
684.28Yu, Wesley Zongrong; Chen, Feng; Cheng, Yi An; Yeung, Ying-Yeung
Catalyst-free and metal-free electrophilic bromoamidation of unactivated olefins using the N-bromosuccinimide/sulfonamide protocol.
The Journal of organic chemistry, 2015, 80, 2815-2821
4036189 CIFC4 H7 B F2 N2 O2P 1 21/n 16.7266; 13.5479; 7.8299
90; 105.259; 90
688.39Morita, Nobuyoshi; Kono, Rina; Fukui, Kenji; Miyazawa, Asuka; Masu, Hyuma; Azumaya, Isao; Ban, Shintaro; Hashimoto, Yoshimitsu; Okamoto, Iwao; Tamura, Osamu
BF3-Mediated cis-Selective Cycloaddition of O-Silyloxime with Alkenes.
The Journal of organic chemistry, 2015, 80, 4797-4802
4030593 CIFC26 H37 Cl O6 S SiP 18.1853; 8.4902; 10.5848
94.6382; 108.843; 91.7329
692.65Uetake, Yuta; Uwamori, Masahiro; Nakada, Masahisa
Enantioselective Approach to Polycyclic Polyprenylated Acylphloroglucinols via Catalytic Asymmetric Intramolecular Cyclopropanation.
The Journal of organic chemistry, 2015, 80, 1735-1745
4036167 CIFC12 H21 N O3 SP 1 21 16.4701; 8.3119; 13.054
90; 93.313; 90
700.86Chernykh, Anton V.; Radchenko, Dmytro S.; Grygorenko, Oleksandr O.; Daniliuc, Constantin G.; Volochnyuk, Dmitriy M.; Komarov, Igor V.
Synthesis and structural analysis of angular monoprotected diamines based on spiro[3.3]heptane scaffold.
The Journal of organic chemistry, 2015, 80, 3974-3981
4036124 CIFC16 H12 Br N O2P -15.6; 10.424; 12.43
86.634; 81.768; 77.572
701Huang, Hai; He, Guangke; Zhu, Guohao; Zhu, Xiaolin; Qiu, Shineng; Zhu, Hongjun
Palladium-catalyzed intramolecular cyclization of ynamides: synthesis of 4-halo-oxazolones.
The Journal of organic chemistry, 2015, 80, 3480-3487
4036166 CIFC12 H21 N O3 SP 1 21 16.4823; 8.3175; 13.0478
90; 93.143; 90
702.43Chernykh, Anton V.; Radchenko, Dmytro S.; Grygorenko, Oleksandr O.; Daniliuc, Constantin G.; Volochnyuk, Dmitriy M.; Komarov, Igor V.
Synthesis and structural analysis of angular monoprotected diamines based on spiro[3.3]heptane scaffold.
The Journal of organic chemistry, 2015, 80, 3974-3981
4031151 CIFC35 H38 O5P 18.181; 9.952; 10.163
79.296; 68.813; 65.825
703.2Barton, Benita; Caira, Mino R.; Hosten, Eric C.; McCleland, Cedric W.; Weitz, Selwyn
Clathrates of TETROL: Further Aspects of the Selective Inclusion of Methylcyclohexanones in Their Energetically Unfavorable Axial Methyl Conformations.
The Journal of organic chemistry, 2015, 80, 7184-7192
4036405 CIFC12 H14 N2 O4 S2P -17.2854; 8.4243; 12.9967
100.849; 94.925; 113.418
707.36Barany, George; Britton, Doyle; Chen, Lin; Hammer, Robert P.; Henley, Matthew J.; Schrader, Alex M.; Young, Jr, Victor G
Unexpectedly Stable (Chlorocarbonyl)(N-ethoxycarbonylcarbamoyl)disulfane, and Related Compounds That Model the Zumach-Weiss-Kühle (ZWK) Reaction for Synthesis of 1,2,4-Dithiazolidine-3,5-diones.
The Journal of organic chemistry, 2015, 80, 11313-11321
4036301 CIFC7 H8 N2 O2P -15.3049; 5.9648; 24.0989
94.598; 90.43; 110.027
713.64Chaiyaveij, Duangduan; Batsanov, Andrei S.; Fox, Mark A.; Marder, Todd B.; Whiting, Andrew
An Experimental and Computational Approach to Understanding the Reactions of Acyl Nitroso Compounds in [4 + 2] Cycloadditions.
The Journal of organic chemistry, 2015, 80, 9518-9534
4030375 CIFC14 H24 N2 OP 1 21 16.2999; 7.7215; 14.823
90; 95.614; 90
717.6Feder-Kubis, Joanna; Szefczyk, Borys; Kubicki, Maciej
Symmetrical Imidazolium Chloride Based on (-)-Menthol: Synthesis, Characterization, and Theoretical Model of the Reaction.
The Journal of organic chemistry, 2014, 80, 237
4031750 CIFC15 H19 N3 O2P 1 21 19.4598; 7.6176; 10.0179
90; 95.575; 90
718.48Chang, Deng-Hsiang; Ou, Chun-Lin; Hsu, Hung-Yu; Huang, Guan-Jhih; Kao, Chen-Yi; Liu, Yi-Hung; Peng, Shie-Ming; Diau, Eric Wei-Guang; Yang, Jye-Shane
Cooperativity and Site-Selectivity of Intramolecular Hydrogen Bonds on the Fluorescence Quenching of Modified GFP Chromophores.
The Journal of organic chemistry, 2015, 80, 12431-12443
4036249 CIFC16 H20 O4 SP -16.7849; 8.4596; 13.1987
104.958; 99.8443; 92.014
718.62Lu, Ping; Herrmann, Aaron T.; Zakarian, Armen
Toward the Synthesis of Nuphar Sesquiterpene Thioalkaloids: Stereodivergent Rhodium-Catalyzed Synthesis of the Thiolane Subunit.
The Journal of organic chemistry, 2015, 80, 7581-7589
4030674 CIFC18 H16 Br NP -19.2639; 9.809; 10.047
102.428; 108.884; 114.342
719.8Imrich, Hans-Georg; Conrad, Jürgen; Bubrin, Denis; Beifuss, Uwe
From nitrobenzenes to substituted tetrahydroquinolines in a single step by a domino reduction/imine formation/aza-diels-alder reaction.
The Journal of organic chemistry, 2015, 80, 2319-2332
4031345 CIFC20 H0 IP -18.6796; 9.6049; 10.2306
64.897; 77.044; 70.121
723.1Pati, Kamalkishore; Michas, Christopher; Allenger, David; Piskun, Ilya; Coutros, Peter S.; Gomes, Gabriel Dos Passos; Alabugin, Igor V.
Synthesis of Functionalized Phenanthrenes via Regioselective Oxidative Radical Cyclization.
The Journal of organic chemistry, 2015, 80, 11706-11717
4030927 CIFC14 H18 O7P 1 21 18.9655; 6.4598; 12.7951
90; 102.099; 90
724.57Hansen, Steen U.; Dalton, Charlotte E.; Baráth, Marek; Kwan, Glenn; Raftery, James; Jayson, Gordon C.; Miller, Gavin J.; Gardiner, John M.
Synthesis of l-Iduronic Acid Derivatives via [3.2.1] and [2.2.2] l-Iduronic Lactones from Bulk Glucose-Derived Cyanohydrin Hydrolysis: A Reversible Conformationally Switched Superdisarmed/Rearmed Lactone Route to Heparin Disaccharides.
The Journal of organic chemistry, 2015, 80, 3777-3789
4031338 CIFC16 H14 N2 O5P -16.9348; 7.8591; 15.3115
81.896; 77.827; 64.116
732.76Stock, Rafaela I.; Nandi, Leandro G.; Nicoleti, Celso R.; Schramm, Adriana D. S.; Meller, Sheila L.; Heying, Renata S.; Coimbra, Daniel F.; Andriani, Karla F.; Caramori, Giovanni F.; Bortoluzzi, Adailton J.; Machado, Vanderlei G.
Synthesis and Solvatochromism of Substituted 4-(Nitrostyryl)phenolate Dyes.
The Journal of organic chemistry, 2015, 80, 7971-7983
4036476 CIFC15 H19 N O4P -17.1677; 8.7831; 12.2082
83.465; 74.368; 85.537
734.43Horta, Pedro; Kuş, Nihal; Henriques, Marta Sofia C.; Paixão, José A; Coelho, Lis; Nogueira, Fátima; O'Neill, Paul M; Fausto, Rui; Cristiano, Maria Lurdes Santos
Quinolone-Hydroxyquinoline Tautomerism in Quinolone 3-Esters. Preserving the 4-Oxoquinoline Structure To Retain Antimalarial Activity.
The Journal of organic chemistry, 2015, 80, 12244-12257
4030290 CIFC19 H16 O5P -16.6262; 7.6055; 16.197
84.686; 81.539; 65.692
735.3Pasciak, Erick M.; Rittichier, Jonathan T.; Chen, Chun-Hsing; Mubarak, Mohammad S.; VanNieuwenhze, Michael S.; Peters, Dennis G.
Electroreductive Dimerization of Coumarin and Coumarin Analogues at Carbon Cathodes.
The Journal of organic chemistry, 2014, 80, 274
4031526 CIFC17 H16 Br N2 OP -19.201; 9.605; 9.688
105.73; 101.83; 107.8
744.9Chang, Yong-Zhi; Li, Ming-Lei; Zhao, Wen-Feng; Wen, Xiaoan; Sun, Hongbin; Xu, Qing-Long
Construction of Oxadiazepines via Lewis Acid-Catalyzed Tandem 1,5-Hydride Shift/Cyclization.
The Journal of organic chemistry, 2015, 80, 9620-9627
4036452 CIFC14 H14 Br N O5P 18.366; 9.56; 11.005
113.946; 107.506; 92.316
753.7Dong, Li; Geng, Caiwei; Jiao, Peng
Silyl Nitronate Cycloadditions Catalyzed by Cu(II)-Bisoxazoline.
The Journal of organic chemistry, 2015, 80, 10992-11002
4036505 CIFC13 H14 N6 O3P -18.3623; 9.5799; 10.5979
103.936; 91.136; 111.334
762.1Erhardt, Hellmuth; Häring, Andreas P; Kotthaus, Andreas; Roggel, Markus; Tong, My Linh; Biallas, Phillip; Jübermann, Martin; Mohr, Fabian; Kirsch, Stefan F.
Geminal Diazides Derived from 1,3-Dicarbonyls: A Protocol for Synthesis.
The Journal of organic chemistry, 2015, 80, 12460-12469
4030587 CIFC16 H14 F2 O3 SP -18.5636; 9.5609; 10.2957
75.98; 75.691; 72.424
765.76Masusai, Chonticha; Soorukram, Darunee; Kuhakarn, Chutima; Tuchinda, Patoomratana; Pakawatchai, Chaveng; Saithong, Saowanit; Reutrakul, Vichai; Pohmakotr, Manat
Synthesis of gem-Difluoromethylenated Polycyclic Cage Compounds.
The Journal of organic chemistry, 2015, 80, 1577-1592
4031751 CIFC16 H21 N3 O2P -17.4623; 7.9403; 14.3735
100.622; 92.419; 112.362
768.19Chang, Deng-Hsiang; Ou, Chun-Lin; Hsu, Hung-Yu; Huang, Guan-Jhih; Kao, Chen-Yi; Liu, Yi-Hung; Peng, Shie-Ming; Diau, Eric Wei-Guang; Yang, Jye-Shane
Cooperativity and Site-Selectivity of Intramolecular Hydrogen Bonds on the Fluorescence Quenching of Modified GFP Chromophores.
The Journal of organic chemistry, 2015, 80, 12431-12443
4030655 CIFC17 H14 N4 O4P 1 n 17.5869; 14.3161; 7.9651
90; 117.226; 90
769.28Iaroshenko, Viktor O.; Gevorgyan, Ashot; Mkrtchyan, Satenik; Arakelyan, Knar; Grigoryan, Tatevik; Yedoyan, Julietta; Villinger, Alexander; Langer, Peter
Transition-metal-catalyzed arylation of nitroimidazoles and further transformations of manipulable nitro group.
The Journal of organic chemistry, 2015, 80, 2103-2119
4030401 CIFC16 H25 N2 OP -16.231; 10.287; 12.24
88.818; 79.149; 89.56
770.4Nocket, Anthony J.; Feng, Yiqing; Weinreb, Steven M.
Construction of the Myrioneuron Alkaloids: A Total Synthesis of (±)-Myrioneurinol.
The Journal of organic chemistry, 2014, 80, 1116
4036194 CIFC16 H18 N2 O5P 1 21 17.5978; 8.3479; 12.4229
90; 97.7471; 90
780.74Zhang, Yilin; Hubbard, Jeremiah W.; Akhmedov, Novruz G.; Petersen, Jeffrey L.; Söderberg, Björn C G
Total synthesis of the tetracyclic indole alkaloid ht-13-B.
The Journal of organic chemistry, 2015, 80, 4783-4790
4036497 CIFC21 H17 N O SP -18.7176; 8.9415; 11.6509
80.906; 68.2812; 68.3448
783.91Lvov, Andrey G.; Shirinian, Valerii Z.; Zakharov, Alexey V.; Krayushkin, Mikhail M.; Kachala, Vadim V.; Zavarzin, Igor V.
General Photoinduced Sequential Electrocyclization/[1,9]-Sigmatropic Rearrangement/Ring-Opening Reaction of Diarylethenes.
The Journal of organic chemistry, 2015, 80, 11491-11500
4031726 CIFC17 H16 N2 O4P -16.6061; 8.907; 13.587
92.376; 91.617; 100.58
784.7Bhaumik, Atanu; Pathak, Tanmaya
Methyl-α-d-2-selenonyl Pent-2-enofuranoside: A Reactive Selenosugar for the Diversity Oriented Synthesis of Enantiomerically Pure Heterocycles, Carbocycles, and Isonucleosides.
The Journal of organic chemistry, 2015, 80, 11057-11064
4030848 CIFC17 H22 O6P 1 21 16.071; 18.734; 7.024
90; 98.101; 90
790.9Boyd, Derek R.; Sharma, Narain D.; Malone, John F.; McIntyre, Peter B. A.; McRoberts, Colin; Floyd, Stewart; Allen, Christopher C. R.; Gohil, Amit; Coles, Simon J.; Horton, Peter N.; Stevenson, Paul J.
Toluene Dioxygenase-Catalyzed Synthesis and Reactions of cis-Diol Metabolites Derived from 2- and 3-Methoxyphenols.
The Journal of organic chemistry, 2015, 80, 3429
4036206 CIFC17 H23 O3 PP 1 21 16.5151; 10.6435; 11.8462
90; 104.009; 90
797.02Gatineau, David; Nguyen, Duc Hanh; Hérault, Damien; Vanthuyne, Nicolas; Leclaire, Julien; Giordano, Laurent; Buono, Gérard
H-adamantylphosphinates as universal precursors of P-stereogenic compounds.
The Journal of organic chemistry, 2015, 80, 4132-4141
4031168 CIFC16 H16 Cl N O3 SP 1 21 16.656; 15.213; 8.0795
90; 102.591; 90
798.4Shaw, Scott A.; Balasubramanian, Balu; Bonacorsi, Samuel; Cortes, Janet Caceres; Cao, Kevin; Chen, Bang-Chi; Dai, Jun; Decicco, Carl; Goswami, Animesh; Guo, Zhiwei; Hanson, Ronald; Humphreys, W. Griffith; Lam, Patrick Y. S.; Li, Wenying; Mathur, Arvind; Maxwell, Brad D.; Michaudel, Quentin; Peng, Li; Pudzianowski, Andrew; Qiu, Feng; Su, Shun; Sun, Dawn; Tymiak, Adrienne A.; Vokits, Benjamin P.; Wang, Bei; Wexler, Ruth; Wu, Dauh-Rurng; Zhang, Yingru; Zhao, Rulin; Baran, Phil S.
Synthesis of Biologically Active Piperidine Metabolites of Clopidogrel: Determination of Structure and Analyte Development.
The Journal of organic chemistry, 2015, 80, 7019-7032
4030332 CIFC20 H15 N3 OP -19.0361; 9.7342; 10.511
83.842; 69.579; 68.224
804.3Yang, Weiguang; Qiao, Rui; Chen, Jiuxi; Huang, Xiaobo; Liu, Miaochang; Gao, Wenxia; Ding, Jinchang; Wu, Huayue
Palladium-Catalyzed Cascade Reaction of 2-Amino-N'-arylbenzohydrazides with Triethyl Orthobenzoates To Construct Indazolo[3,2-b]quinazolinones.
The Journal of organic chemistry, 2014, 80, 482
4031081 CIFC4 H7 N3 O6P 1 21/c 113.471; 6.399; 9.737
90; 106.543; 90
804.6Axthammer, Quirin J.; Krumm, Burkhard; Klapötke, Thomas M
Synthesis of Energetic Nitrocarbamates from Polynitro Alcohols and Their Potential as High Energetic Oxidizers.
The Journal of organic chemistry, 2015, 80, 6329-6335
4031344 CIFC8 H9 N3 OP -18.2989; 10.3062; 10.3246
72.166; 86.199; 73.29
804.9Coogan, Niall T.; Chimes, Michael A.; Raftery, James; Mocilac, Pavle; Denecke, Melissa A.
Regioselective Synthesis of V-Shaped Bistriazinyl-phenanthrolines.
The Journal of organic chemistry, 2015, 80, 8684-8693
4030877 CIFC18 H15 Br O3P 1 21 15.83; 8.288; 16.725
90; 92.845; 90
807.1Wei, Ai-Jia; Nie, Jing; Zheng, Yan; Ma, Jun-An
Ni-Catalyzed Highly Chemo-, Regio-, and Enantioselective Decarboxylative Aldol Reaction of β,γ-Unsaturated α-Ketoesters with β-Ketoacids.
The Journal of organic chemistry, 2015, 80, 3766-3776
4031100 CIFC23 H15 Br OP 1 21 111.158; 6.258; 12.637
90; 113.207; 90
811Usui, Kazuteru; Yamamoto, Kosuke; Shimizu, Takashi; Okazumi, Mieko; Mei, Biao; Demizu, Yosuke; Kurihara, Masaaki; Suemune, Hiroshi
Synthesis and Resolution of Substituted [5]Carbohelicenes.
The Journal of organic chemistry, 2015, 80, 6502-6508
4030453 CIFC22 H14 O3P -19.696; 10.159; 10.316
61.424; 78.793; 65.588
812.6Yan, Kelu; Yang, Daoshan; Wei, Wei; Wang, Fen; Shuai, Yuanyuan; Li, Qiannan; Wang, Hua
Silver-Mediated Radical Cyclization of Alkynoates and α-Keto Acids Leading to Coumarins via Cascade Double C-C Bond Formation.
The Journal of organic chemistry, 2015, 80, 1550-1556
4036242 CIFC15 H7 B Cl4 F2 N2 OP -19.8021; 10.0817; 10.865
95.24; 112.368; 118.931
817.14Zhao, Ning; Xuan, Sunting; Fronczek, Frank R.; Smith, Kevin M.; Vicente, M Graça H
Stepwise Polychlorination of 8-Chloro-BODIPY and Regioselective Functionalization of 2,3,5,6,8-Pentachloro-BODIPY.
The Journal of organic chemistry, 2015, 80, 8377-8383
4036184 CIFC18 H19 N O4P 1 21 17.7461; 13.7554; 8.0544
90; 106.57; 90
822.56Bailey, William F.; Lambert, Kyle M.; Wiberg, Kenneth B.; Mercado, Brandon Q.
Effect of remote aryl substituents on the conformational equilibria of 2,2-diaryl-1,3-dioxanes: importance of electrostatic interactions.
The Journal of organic chemistry, 2015, 80, 4108-4115
4030849 CIFC17 H22 O6P 1 21 16.6036; 19.939; 6.6798
90; 110.291; 90
824.94Boyd, Derek R.; Sharma, Narain D.; Malone, John F.; McIntyre, Peter B. A.; McRoberts, Colin; Floyd, Stewart; Allen, Christopher C. R.; Gohil, Amit; Coles, Simon J.; Horton, Peter N.; Stevenson, Paul J.
Toluene Dioxygenase-Catalyzed Synthesis and Reactions of cis-Diol Metabolites Derived from 2- and 3-Methoxyphenols.
The Journal of organic chemistry, 2015, 80, 3429
4030470 CIFC17 H23 N O3 SP 1 21 110.489; 7.978; 10.912
90; 115.008; 90
827.5Martinand-Lurin, Elodie; Gruber, Raymond; Retailleau, Pascal; Fleurat-Lessard, Paul; Dauban, Philippe
Studies on the formal [3 + 2] cycloaddition of aziridines with alkenes for the synthesis of 1-azaspiroalkanes.
The Journal of organic chemistry, 2015, 80, 1414-1426
4031083 CIFC3 H3 F N4 O8P 1 21/c 114.716; 5.985; 9.6928
90; 103.728; 90
829.3Axthammer, Quirin J.; Krumm, Burkhard; Klapötke, Thomas M
Synthesis of Energetic Nitrocarbamates from Polynitro Alcohols and Their Potential as High Energetic Oxidizers.
The Journal of organic chemistry, 2015, 80, 6329-6335
4030670 CIFC18 H17 N3 O4P -18.171; 8.979; 11.675
95.56; 95.62; 101.11
830.6Tang, Jian; Grampp, Günter; Liu, Yun; Wang, Bing-Xiang; Tao, Fei-Fei; Wang, Li-Jun; Liang, Xue-Zheng; Xiao, Hui-Quan; Shen, Yong-Miao
Visible Light Mediated Cyclization of Tertiary Anilines with Maleimides Using Nickel(II) Oxide Surface-Modified Titanium Dioxide Catalyst.
The Journal of organic chemistry, 2015, 80, 2724-2732
4036321 CIFC15 H13 Cl3 O6P -18.829; 9.24; 11.236
109.714; 99.852; 97.848
831.3Ram, Ram N.; Soni, Vineet Kumar
Synthesis of α-Functionalized Trichloromethylcarbinols.
The Journal of organic chemistry, 2015, 80, 8922-8928
4030727 CIFC16 H16 Cl N3 O4P -18.9484; 10.234; 11.213
116.439; 93.526; 110.517
831.7Valiulin, Roman A.; Mamidyala, Sreeman; Finn, M. G.
Taming chlorine azide: access to 1,2-azidochlorides from alkenes.
The Journal of organic chemistry, 2015, 80, 2740-2755
4036275 CIFC15 H11 Cl3 N0 O3 S2P -15.6891; 10.2427; 15.0808
107.955; 91.44; 94.341
832.5Luo, Hongmei; Pan, Ling; Xu, Xianxiu; Liu, Qun
Friedel-Crafts Coupling of Electron-Deficient Benzoylacetones Tuned by Remote Electronic Effects.
The Journal of organic chemistry, 2015, 80, 8282-8289
4030995 CIFC18 H20 F2 N2 O2P 17.3111; 8.9012; 14.1362
72.375; 78.013; 74.229
835.84Engel-Andreasen, Jens; Wich, Kathrine; Laursen, Jonas S.; Harris, Pernille; Olsen, Christian A.
Effects of thionation and fluorination on cis-trans isomerization in tertiary amides: an investigation of N-alkylglycine (peptoid) rotamers.
The Journal of organic chemistry, 2015, 80, 5415-5427
4030669 CIFC9 H12 N2 OP 21 21 216.6807; 7.3529; 17.0246
90; 90; 90
836.29Wagner, Alexander; Ofial, Armin R.
Potassium Thiocyanate as Source of Cyanide for the Oxidative α-Cyanation of Tertiary Amines.
The Journal of organic chemistry, 2015, 80, 2848-2854
4030695 CIFC16 H15 Br F3 N O3 SP -18.112; 10.284; 11.166
82.569; 72.55; 70.601
837.7Yu, Wesley Zongrong; Chen, Feng; Cheng, Yi An; Yeung, Ying-Yeung
Catalyst-free and metal-free electrophilic bromoamidation of unactivated olefins using the N-bromosuccinimide/sulfonamide protocol.
The Journal of organic chemistry, 2015, 80, 2815-2821
4030563 CIFC21 H16 N2 O3P -17.4641; 10.1247; 11.5543
93.217; 105.398; 93.602
837.76Rao, H. Surya Prakash; Rao, A. Veera Bhadra
Copper-Catalyzed C(sp(3))-OH Cleavage with Concomitant C-C Coupling: Synthesis of 3-Substituted Isoindolinones.
The Journal of organic chemistry, 2015, 80, 1506-1516
4036247 CIFC16 H22 O8P 1 21 15.5897; 16.686; 9.1104
90; 97.632; 90
842.2Häcker, Christine; Plietker, Bernd
General Stereodivergent Enantioselective Total Synthetic Approach toward Macrosphelides A-G and M.
The Journal of organic chemistry, 2015, 80, 8055-8064
4031556 CIFC20 H25 N O3P -15.8068; 9.2151; 16.0074
98.259; 92.438; 92.623
845.74Harada, Shingo; Kono, Masato; Nozaki, Tomoyuki; Menjo, Yasuhiro; Nemoto, Tetsuhiro; Hamada, Yasumasa
General Approach to Nitrogen-Bridged Bicyclic Frameworks by Rh-Catalyzed Formal Carbenoid Insertion into an Amide C-N Bond.
The Journal of organic chemistry, 2015, 80, 10317-10333
4031104 CIFC7 H9 N O3 SP 1 21/c 111.2301; 4.8137; 15.8196
90; 97.237; 90
848.37Zhong, Yuan; Ma, Shixiong; Li, Bai; Jiang, Xianxing; Wang, Rui
Diastereoselective Synthesis of Biheterocyclic Tetrahydrothiophene Derivatives via Base-Catalyzed Cascade Michael-Aldol [3 + 2] Annulation of 1,4-Dithiane-2,5-diol with Maleimides.
The Journal of organic chemistry, 2015, 80, 6870-6874
4030977 CIFC21 H14 N O PP 1 21 112.0467; 6.5161; 12.2531
90; 117.784; 90
850.95Matano, Yoshihiro; Motegi, Yuta; Kawatsu, Shinsuke; Kimura, Yoshifumi
Comparison of 2-Arylnaphtho[2,3-b]phospholes and 2-Arylbenzo[b]phospholes: Effects of 2-Aryl Groups and Fused Arene Moieties on Their Optical and Photophysical Properties.
The Journal of organic chemistry, 2015, 80, 5944-5950
4031554 CIFC16 H25 N O6P -19.6378; 10.0839; 10.0864
90.206; 103.919; 115.144
855.05Harada, Shingo; Kono, Masato; Nozaki, Tomoyuki; Menjo, Yasuhiro; Nemoto, Tetsuhiro; Hamada, Yasumasa
General Approach to Nitrogen-Bridged Bicyclic Frameworks by Rh-Catalyzed Formal Carbenoid Insertion into an Amide C-N Bond.
The Journal of organic chemistry, 2015, 80, 10317-10333
4036149 CIFC14 H18 Cl3 N O2 SP 1 21 110.723; 6.055; 13.7208
90; 105.927; 90
856.66Lebel, Hélène; Piras, Henri
Stereoselective synthesis of chiral sulfilimines from N-mesyloxycarbamates: metal-nitrenes versus metal-nitrenoids species.
The Journal of organic chemistry, 2015, 80, 3572-3585
4030960 CIFC23 H15 Br O4P -18.3918; 9.3294; 12.1587
70.646; 82.2385; 72.7588
857.04Ota, Motohiro; Sasamori, Takahiro; Tokitoh, Norihiro; Onodera, Takefumi; Mizushina, Yoshiyuki; Kuramochi, Kouji; Tsubaki, Kazunori
Synthesis, Photochemical Properties, and Cytotoxicities of 2H-Naphtho[1,2-b]pyran and Its Photodimers.
The Journal of organic chemistry, 2015, 80, 5687-5695
4030692 CIFC16 H15 Br F3 N O2 SP -16.805; 8.529; 15.363
74.591; 89.569; 87.535
858.8Yu, Wesley Zongrong; Chen, Feng; Cheng, Yi An; Yeung, Ying-Yeung
Catalyst-free and metal-free electrophilic bromoamidation of unactivated olefins using the N-bromosuccinimide/sulfonamide protocol.
The Journal of organic chemistry, 2015, 80, 2815-2821
4030449 CIFC19 H17 N O4 SP -19.6997; 9.9793; 10.2055
66.838; 73.565; 80.221
869.2Webster, S.; Young, P. C.; Barker, G.; Rosair, G. M.; Lee, A.-L.
Dehydrative Thiolation of Allenols: Indium vs Gold Catalysis.
The Journal of organic chemistry, 2015, 80, 1703-1718
4036273 CIFC22 H15 Br N2 OP -17.1795; 10.267; 13.022
73.24; 86.19; 71.15
869.4Ding, Zong-Cang; Tang, Hai-Tao; Li, Ren-Hao; Ju, Lu-Chuan; Zhan, Zhuang-Ping
Synthesis of 4-Arylidenepyrazolones by a Gold-Catalyzed Cyclization/Arylidene Group Transfer Cascade of N-Propioloyl Hydrazones.
The Journal of organic chemistry, 2015, 80, 9307-9313
4030987 CIFC19 H22 N2 O SP -18.6606; 8.8909; 11.7871
78.273; 86.46; 78.272
869.92Engel-Andreasen, Jens; Wich, Kathrine; Laursen, Jonas S.; Harris, Pernille; Olsen, Christian A.
Effects of thionation and fluorination on cis-trans isomerization in tertiary amides: an investigation of N-alkylglycine (peptoid) rotamers.
The Journal of organic chemistry, 2015, 80, 5415-5427
4036145 CIFC21 H15 I O2P -15.7653; 8.9351; 17.7277
89.483; 88.583; 72.496
870.66Priebbenow, Daniel L.; Gable, Robert W.; Baell, Jonathan
Regio- and stereoselective iodoacyloxylations of alkynes.
The Journal of organic chemistry, 2015, 80, 4412-4418
4031333 CIFC23 H21 N OP 1 21 18.4016; 9.9253; 10.5431
90; 97.2928; 90
872.06Bulman Page, Philip C.; Pearce, Christopher A.; Chan, Yohan; Parker, Phillip; Buckley, Benjamin R.; Rassias, Gerasimos A.; Elsegood, Mark R. J.
Atropo- and Diastereoselective Construction of Tetracyclic Biphenylazepinium Salts Derived from Aminoalcohols: Use as Catalysts in Enantioselective Asymmetric Epoxidation.
The Journal of organic chemistry, 2015, 80, 8036-8045
4036238 CIFC16 H9 B Cl4 F2 N2 OP -17.677; 10.992; 11.053
74.562; 76.37; 84.892
873.4Zhao, Ning; Xuan, Sunting; Fronczek, Frank R.; Smith, Kevin M.; Vicente, M Graça H
Stepwise Polychlorination of 8-Chloro-BODIPY and Regioselective Functionalization of 2,3,5,6,8-Pentachloro-BODIPY.
The Journal of organic chemistry, 2015, 80, 8377-8383
4030556 CIFC20 H23 N3 OP -17.9118; 9.9589; 12.639
69.83; 86.015; 69.41
873.6Feng, Xian; Wang, Jian-Jun; Xun, Zhan; Huang, Zhi-Bin; Shi, Da-Qing
Multicomponent Strategy to Indeno[2,1-c]pyridine and Hydroisoquinoline Derivatives through Cleavage of Carbon-Carbon Bond.
The Journal of organic chemistry, 2015, 80, 1025
4031073 CIFC11 H13 NP 1 21/c 16.3432; 11.6806; 11.8916
90; 97.09; 90
874.34Bremer, Matthias; Untenecker, Harald; Gunchenko, Pavel A.; Fokin, Andrey A.; Schreiner, Peter R.
Inverted Carbon Geometries: Challenges to Experiment and Theory.
The Journal of organic chemistry, 2015, 80, 6520-6524
4031074 CIFC19 H17 Br N2 O3P 1 21 110.3611; 6.327; 14.2252
90; 110.316; 90
874.52Mao, Jian-Hui; Wang, Zi-Tian; Wang, Zhan-Yong; Cheng, Ying
N-Heterocyclic Carbene-Catalyzed Oxidative Annulations of α,β-Unsaturated Aldehydes with Hydrazones: Selective Synthesis of Optically Active 4,5-Dihydropyridazin-3-ones and Pyridazin-3-ones.
The Journal of organic chemistry, 2015, 80, 6350-6359
4030591 CIFC15 H21 Br N O6 PP 1 21 110.158; 6.593; 13.228
90; 98.716; 90
875.7Bera, Kalisankar; Namboothiri, Irishi N. N.
Quinine-Derived Thiourea and Squaramide Catalyzed Conjugate Addition of α-Nitrophosphonates to Enones: Asymmetric Synthesis of Quaternary α-Aminophosphonates.
The Journal of organic chemistry, 2015, 80, 1402-1413

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