Crystallography Open Database

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4023026 CIFC H Cl N OP 1 21/c 17.3223; 16.257; 15.537
90; 101.432; 90
1812.8Tao Xiong; Qian Zhang; Zhiguo Zhang; Qun Liu
A Divergent Synthesis of γ-Iminolactones, Dihydroquinolin-2-ones, and γ-Lactames from β-Hydroxymethylcyclopropanylamides
Journal of Organic Chemistry, 2007, 72, 8005-8009
4027424 CIFC H Cl N OP n a 2113.8598; 11.5756; 23.3102
90; 90; 90
3739.8Zhiguo Zhang; Shiliang Fang; Qingfeng Liu; Guisheng Zhang
Approach to Polysubstituted 4-Pyridones from N-Aryl Acetoacetamides via a N to C1,3-Acyl Migration Mediated by Sodium Persulfate
Journal of Organic Chemistry, 2012, 77, 7665-7670
4025304 CIFC H IC 1 2/c 130.2468; 18.3785; 17.2888
90; 96.041; 90
9557.3Frances A. Murphy; Sylvia M. Draper
Superaromatic Terpyridines: Hexa-peri-hexabenzocoronenes with Tridentate Functionality
Journal of Organic Chemistry, 2010, 75, 1862-1870
4020372 CIFC H N SP 21 21 216.928; 9.9129; 12.5725
90; 90; 90
863.44Li Gao; Rawle I. Hollingsworth
Design and Evaluation of Dihydroxytetrahydro-1H-pyrrolo[2,1-c]-[1,4]benzothiazines as Conformationally Restricted Transition-State Inhibitors of β-Ribosidases
Journal of Organic Chemistry, 2005, 70, 9013-9016
4027917 CIFC H OP -312.0399; 12.0399; 9.8716
90; 90; 120
1239.26Tao Wang; Yu-Fei Zhang; Qin-Qing Hou; Wen-Rong Xu; Xiao-Ping Cao; Hak-Fun Chow; Dietmar Kuck
C3-Symmetrical Tribenzotriquinacene Derivatives: Optical Resolution through Cryptophane Synthesis and Supramolecular Self-Assembly into Nanotubes
Journal of Organic Chemistry, 2013, 78, 1062-1069
4038501 CIFC1.714 H1.486 N0.343P 1 21/n 17.022; 11.2016; 15.789
90; 99.001; 90
1226.6Kumar, Neha; Agrawal, Abhijeet R.; Choudhury, Aditya; Zade, Sanjio S.
The Effect of Base and Nucleophile on the Nucleophilic Substitution of Methoxytropone Derivatives: An Easy Access to 4- and 5-Substituted Multifunctional Azulenes.
The Journal of organic chemistry, 2020
4020280 CIFC10 H10 Ag N O3 Se5P 1 21/n 110.725; 11.207; 12.938
90; 93.565; 90
1552.1Toshio Shimizu; Mari Kawaguchi; Takahiro Tsuchiya; Kazunori Hirabayashi; Nobumasa Kamigata
Journal of Organic Chemistry, 2005, 70, 5036-5044
4033735 CIFC10 H10 B0.25 Cl0.25 F0.25 N2 O3P -110.1007; 11.0329; 12.8754
114.896; 108.439; 94.763
1195.08Belmonte-Vázquez, José L; Avellanal-Zaballa, Edurne; Enríquez-Palacios, Ernesto; Cerdán, Luis; Esnal, Ixone; Bañuelos, Jorge; Villegas-Gómez, Clarisa; López Arbeloa, Iñigo; Peña-Cabrera, Eduardo
Synthetic Approach to Readily Accessible Benzofuran-Fused Borondipyrromethenes as Red-Emitting Laser Dyes.
The Journal of organic chemistry, 2019, 84, 2523-2541
4020656 CIFC10 H10 Br2 N2 O3P 21 21 215.497; 9.9352; 23.478
90; 90; 90
1282.2Jignesh Patel; Nadia Pelloux-Léon; Frédéric Minassian; Yannick Vallée
Syntheses of S-Enantiomers of Hanishin, Longamide B, and Longamide B Methyl Ester from L-Aspartic Acid β-Methyl Ester: Establishment of Absolute Stereochemistry
Journal of Organic Chemistry, 2005, 70, 9081-9084
4020461 CIFC10 H10 Br2 N2 O5C 1 2/c 138.2555; 4.6699; 14.6279
90; 94.597; 90
2604.86J. Jonathan Harburn; Nigam P. Rath; Christopher D. Spilling
Journal of Organic Chemistry, 2005, 70, 6398-6403
4026258 CIFC10 H10 Br2 O6C 1 c 116.458; 6.3995; 13.491
90; 115.273; 90
1284.9Faiz Ahmed Khan; Ch. Nageswara Rao
Grob Fragmentation of Norbornyl α-Diketones: A Route to α-Ketoenols and Aromatic Compounds
Journal of Organic Chemistry, 2011, 76, 3320-3328
4034969 CIFC10 H10 Cl N O2 SP 1 21/c 110.2094; 14.5436; 7.83158
90; 109.471; 90
1096.34Samper Barceló, Víctor; Bienz, Stefan
Synthesis of Highly Substituted 3-Pyrrolin-2-ones from N,N-Disubstituted α-Amino Acids.
The Journal of organic chemistry, 2018, 83, 2734-2743
4032484 CIFC10 H10 Cl N5 OP 1 21/c 16.147; 13.509; 13.966
90; 105.541; 90
1117.3Centore, Roberto; Manfredi, Carla; Capobianco, Amedeo; Volino, Sabato; Ferrara, Maria Vittoria; Carella, Antonio; Fusco, Sandra; Peluso, Andrea
Solid State Separation and Isolation of Tautomers of Fused-Ring Triazolotriazoles.
The Journal of organic chemistry, 2017
4028635 CIFC10 H10 Cl0 N2 O2P 21 21 217.4578; 9.7077; 50.505
90; 90; 90
3656.5Veerle Smout; Aldo Peschiulli; Stefan Verbeeck; Emily A. Mitchell; Wouter Herrebout; Patrick Bultinck; Christophe M. L. Vande Velde; Didier Berthelot; Lieven Meerpoel; Bert U. W. Maes
Removal of the Pyridine Directing Group from α-Substituted N-(Pyridin-2-yl)piperidines Obtained via Directed Ru-Catalyzed sp3 C-H Functionalization
Journal of Organic Chemistry, 2013, 78, 9803-9814
4022531 CIFC10 H10 Cl2 N2 S2 ZnC 1 2/c 19.345; 11.447; 13.661
90; 109.105; 90
1380.9John Y. L. Chung; Raymond J. Cvetovich; Fuh-Rong Tsay; Peter G. Dormer; Lisa DiMichele; David J. Mathre; Jennifer R. Chilenski; Bing Mao; Robert Wenslow
Synthesis of 3-Aminopyrazinone Mediated by 2-Pyridylthioimidate-ZnCl~2~ Complexes. Development of an Efficient Route to a Thrombin Inhibitor
Journal of Organic Chemistry, 2003, 68, 8838-8846
4032502 CIFC10 H10 F N O4P 1 21/c 113.8582; 8.4793; 17.1636
90; 94.026; 90
2011.9Motornov, Vladimir A.; Muzalevskiy, Vasiliy M.; Tabolin, Andrey A.; Novikov, Roman A.; Nelyubina, Yulia V.; Nenajdenko, Valentine G.; Ioffe, Sema L.
Radical Nitration-Debromination of α-Bromo-α-fluoroalkenes as a Stereoselective Route to Aromatic α-Fluoronitroalkenes-Functionalized Fluorinated Building Blocks for Organic Synthesis.
The Journal of organic chemistry, 2017
4022632 CIFC10 H10 F2 N2 O4P 1 21 16.5347; 7.0844; 11.655
90; 96.388; 90
536.21Ireneusz Nowak; John F. Cannon; Morris J. Robins
Addition of Difluorocarbene to 3',4'-Unsaturated Nucleosides: Synthesis of 2'-Deoxy Analogues with a 2-Oxabicyclo[3.1.0]hexane Framework
Journal of Organic Chemistry, 2007, 72, 532-537
4022842 CIFC10 H10 F2 N2 O5P 1 21 16.9293; 7.5038; 10.7401
90; 93.891; 90
557.16Ireneusz Nowak; Morris J. Robins
Synthesis of 3'-Deoxynucleosides with 2-Oxabicyclo[3.1.0]hexane Sugar Moieties: Addition of Difluorocarbene to a 3',4'-Unsaturated Uridine Derivative and 1,2-Dihydrofurans Derived from D- and L-Xylose
Journal of Organic Chemistry, 2007, 72, 3319-3325
4021141 CIFC10 H10 F3 N O7P -15.139; 7.391; 16.684
98.61; 96.12; 94.06
620.55Matthias Pohlman; Uli Kazmaier; Thomas Lindner
Allylic Alkylation versus Michael Induced Ring Closure: Chelated Enolates as Versatile Nucleophiles
Journal of Organic Chemistry, 2004, 69, 6909-6912
4032035 CIFC10 H10 F5 N O5 SP 1 21/c 114.587; 6.5046; 15.2015
90; 116.131; 90
1294.9Ponomarenko, Maksym V.; Grabowsky, Simon; Pal, Rumpa; Röschenthaler, Gerd-Volker; Fokin, Andrey A.
SF5-Enolates in Ti(IV)-Mediated Aldol Reactions.
The Journal of organic chemistry, 2016, 81, 6783-6791
4020789 CIFC10 H10 N10 O10P 21 21 217.1557; 7.5846; 36.427
90.005; 90.002; 89.94
1977Huaqing Liu; Francis A. Kerdesky; Lawrence A. Black; Michael Fitzgerald; Rodger Henry; Timothy A. Esbenshade; Arthur A. Hancock; Youssef L. Bennani
An Efficient Multigram Synthesis of the Potent Histamine H~3~ Antagonist GT-2331 and the Reassessment of the Absolute Configuration
Journal of Organic Chemistry, 2004, 69, 192-194
4031917 CIFC10 H10 N2 OP 21 21 216.6165; 8.5077; 15.0826
90; 90; 90
849.02Zhang, Shi-Jin; Sun, Wen-Wu; Cao, Pei; Dong, Xiao-Ping; Liu, Ji-Kai; Wu, Bin
Stereoselective Synthesis of Diazabicyclic β-Lactams through Intramolecular Amination of Unactivated C(sp(3))-H Bonds of Carboxamides by Palladium Catalysis.
The Journal of organic chemistry, 2016, 81, 956-968
4033544 CIFC10 H10 N2 OP 1 21/n 18.3909; 8.3286; 12.4602
90; 93.482; 90
869.17Derosa, Joseph; O'Duill, Miriam L; Holcomb, Matthew; Boulous, Mark N.; Patman, Ryan L.; Wang, Fen; Tran-Dubé, Michelle; McAlpine, Indrawan; Engle, Keary M.
Copper-Catalyzed Chan-Lam Cyclopropylation of Phenols and Azaheterocycles.
The Journal of organic chemistry, 2018, 83, 3417-3425
4034536 CIFC10 H10 N2 OP 1 21/c 145.984; 14.1262; 15.9483
90; 92.21; 90
10352Bisht, Girish Singh; Gnanaprakasam, Boopathy
Transition-Metal-Free Addition Reaction for the Synthesis of 3-(Aminobenzylidene/aminoalkylidene)indolin-2-ones and Its Synthetic Applications.
The Journal of organic chemistry, 2019, 84, 13516-13527
4032507 CIFC10 H10 N2 O2P 1 21/n 15.793; 23.033; 7.148
90; 102.186; 90
932.3Yedage, Subhash Laxman; Bhanage, Bhalchandra M.
tert-Butyl Nitrite Mediated Synthesis of N-nitrosoamides, Carboxylic Acids, Benzocoumarins and Isocoumarins from Amides.
The Journal of organic chemistry, 2017
4035001 CIFC10 H10 N2 O2P c a 2113.755; 5.1325; 25.638
90; 90; 90
1810Maity, Rajib; Naskar, Sandip; Das, Indrajit
Copper(II)-Catalyzed Reactions of α-Keto Thioesters with Azides via C-C and C-S Bond Cleavages: Synthesis of N-Acylureas and Amides.
The Journal of organic chemistry, 2018, 83, 2114-2124
4037855 CIFC10 H10 N2 O3P 1 21/c 19.6285; 11.3962; 9.9019
90; 115.8; 90
978.21Bracken, Cormac; Baumann, Marcus
Development of a Continuous Flow Photoisomerization Reaction Converting Isoxazoles into Diverse Oxazole Products.
The Journal of organic chemistry, 2020
4025614 CIFC10 H10 N2 O4P 1 21/n 110.626; 5.8228; 16.673
90; 104.11; 90
1000.5Marcus Angelin; Martin Rahm; Andreas Fischer; Tore Brinck; Olof Ramström
Diastereoselective One-Pot Tandem Synthesis of 3-Substituted Isoindolinones: A Mechanistic Investigation
Journal of Organic Chemistry, 2010, 75, 5882-5887
4029014 CIFC10 H10 N2 O4P -17.107; 7.758; 10.62
75.924; 79.636; 71.112
534.1Wang, Zheng-Lin; Li, Hong-Liang; Ge, Li-Shi; An, Xing-Lan; Zhang, Zi-Gang; Luo, Xiaoyan; Fossey, John S.; Deng, Wei-Ping
DDQ-Mediated Oxidative Coupling: An Approach to 2,3-Dicyanofuran (Thiophene).
The Journal of organic chemistry, 2014, 79, 1156
4026507 CIFC10 H10 N2 O6 SP 21 21 217.6599; 9.3279; 16.515
90; 90; 90
1180Suneel P. Singh; Alex Michaelides; A. Rod Merrill; Adrian L. Schwan
A Microwave-Assisted Synthesis of (S)-N-Protected Homoserine γ-Lactones from l-Aspartic Acid
Journal of Organic Chemistry, 2011, 76, 6825-6831
4026096 CIFC10 H10 N2 P2 S5P -19.382; 12.916; 13.29
89.09; 88.04; 86.02
1605.5Jan Bergman; Birgitta Pettersson; Vedran Hasimbegovic; Per H. Svensson
Thionations Using a P4S10-Pyridine Complex in Solvents Such as Acetonitrile and Dimethyl Sulfone
Journal of Organic Chemistry, 2011, 76, 1546-1553
4030565 CIFC10 H10 N2 S2P 1 21/c 19.656; 8.9641; 11.7189
90; 96.272; 90
1008.29Aruri, Hariprasad; Singh, Umed; Sharma, Sumit; Gudup, Satish; Bhogal, Mukesh; Kumar, Sanjay; Singh, Deepika; Gupta, Vivek K.; Kant, Rajni; Vishwakarma, Ram A.; Singh, Parvinder Pal
Cross-Dehydrogenative Coupling of Azoles with α-C(sp(3))-H of Ethers and Thioethers under Metal-Free Conditions: Functionalization of H-N Azoles via C-H Activation.
The Journal of organic chemistry, 2015, 80, 1929-1936
4022530 CIFC10 H10 N4 OC 1 c 14.47; 23.896; 9.34
90; 99.376; 90
984.3Marcus H. Holschbach; Dionisia Sanz; Rosa M. Claramunt; Lourdes Infantes; Sam Motherwell; Paul R. Raithby; María Luisa Jimeno; David Herrero; Ibon Alkorta; Nadine Jagerovic; José Elguero
Structure of a 4-Nitroso-5-aminopyrazole and Its Salts: Tautomerism, Protonation, and E/Z Isomerism
Journal of Organic Chemistry, 2003, 68, 8831-8837
4025682 CIFC10 H10 O S3P 1 21/n 113.169; 6.129; 13.994
90; 108.241; 90
1072.7William Clegg; Ross W. Harrington; Michael North; Pedro Villuendas
A Bimetallic Aluminum(salen) Complex for the Synthesis of 1,3-Oxathiolane-2-thiones and 1,3-Dithiolane-2-thiones
Journal of Organic Chemistry, 2010, 75, 6201-6207
4023154 CIFC10 H10 O S5P 1 21/c 17.196; 18.705; 10.344
90; 108.95; 90
1316.9Takahiro Tsuchiya; Yosuke Okada; Toshio Shimizu; Kazunori Hirabayashi; Nobumasa Kamigata
Molecular Transformations of Unsaturated Thiacrown Ethers
Journal of Organic Chemistry, 2008, 73, 76-80
4028822 CIF
HKL
C10 H10 O3P 1 21/n 18.2592; 5.45466; 38.5981
90; 91.672; 90
1738.15Joanna V. Geden; Benjamin O. Beasley; Guy J. Clarkson; Michael Shipman
Asymmetric Synthesis of 2-Substituted Oxetan-3-ones via Metalated SAMP/RAMP Hydrazones
Journal of Organic Chemistry, 2013, 78, 12243-12250
4028823 CIF
HKL
C10 H10 O3P 1 21/n 15.91473; 17.3076; 8.6214
90; 100.809; 90
866.91Joanna V. Geden; Benjamin O. Beasley; Guy J. Clarkson; Michael Shipman
Asymmetric Synthesis of 2-Substituted Oxetan-3-ones via Metalated SAMP/RAMP Hydrazones
Journal of Organic Chemistry, 2013, 78, 12243-12250
4037897 CIFC10 H10 O4P -17.6463; 11.753; 12.203
117.17; 100.016; 90.347
956.2Kumar, Anil; Prabhu, Kandikere Ramaiah
Rhodium(III)-Catalyzed C-H Activation: A Cascade Approach for the Regioselective Synthesis of Fused Heterocyclic Lactone Scaffolds.
The Journal of organic chemistry, 2020
4022088 CIFC10 H11 F2 N3 O3P 1 21 15.3533; 17.484; 12.0785
90; 100.109; 90
1113Ireneusz Nowak; Morris J. Robins
Addition of Difluorocarbene to 4',5'-Unsaturated Nucleosides: Synthesis and Deoxygenation Reactions of Difluorospirocyclopropane Nucleosides
Journal of Organic Chemistry, 2006, 71, 8876-8883
4022843 CIFC10 H11 F2 N3 O4P 21 21 216.2374; 9.8577; 18.1082
90; 90; 90
1113.41Ireneusz Nowak; Morris J. Robins
Synthesis of 3'-Deoxynucleosides with 2-Oxabicyclo[3.1.0]hexane Sugar Moieties: Addition of Difluorocarbene to a 3',4'-Unsaturated Uridine Derivative and 1,2-Dihydrofurans Derived from D- and L-Xylose
Journal of Organic Chemistry, 2007, 72, 3319-3325
4036923 CIFC10 H11 F3 N2 OP 1 21/c 18.9513; 4.8424; 25.886
90; 102.982; 90
1093.4Zhu, Mei; Han, Xin; Fu, Weijun; Wang, Zhiqiang; Ji, Baoming; Hao, Xin-Qi; Song, Mao-Ping; Xu, Chen
Regioselective 2,2,2-Trifluoroethylation of Imidazopyridines by Visible Light Photoredox Catalysis.
The Journal of organic chemistry, 2016, 81, 7282-7287
4034831 CIFC10 H11 N O S SeP 1 21/c 110.079; 9.9043; 11.905
90; 107.125; 90
1135.7Shangpliang, O. Risuklang; Kshiar, Baskhemlang; Wanniang, Kmendashisha; Marpna, Ibakyntiew D.; Lipon, Tyrchain Mitre; Laloo, Badaker M.; Myrboh, Bekington
Selenium Dioxide As an Alternative Reagent for the Direct α-Selenoamidation of Aryl Methyl Ketones.
The Journal of organic chemistry, 2018, 83, 5829-5835
4026034 CIFC10 H11 N O2P 21 21 219.306; 13.832; 14.42
90; 90; 90
1856.2Tula B. Bisol; Adailton J. Bortoluzzi; Marcus M. Sá
Nucleophilic Ring-Opening of Epoxide and Aziridine Acetates for the Stereodivergent Synthesis of β-Hydroxy and β-Amino γ-Lactams
Journal of Organic Chemistry, 2011, 76, 948-962
4026035 CIFC10 H11 N O2P -18.553; 8.7103; 12.809
80.9; 89.75; 74.15
905.7Tula B. Bisol; Adailton J. Bortoluzzi; Marcus M. Sá
Nucleophilic Ring-Opening of Epoxide and Aziridine Acetates for the Stereodivergent Synthesis of β-Hydroxy and β-Amino γ-Lactams
Journal of Organic Chemistry, 2011, 76, 948-962
4032328 CIFC10 H11 N O2P 1 21/c 111.512; 9.57; 9.098
90; 112.68; 90
924.8Pigulski, Bartłomiej; Męcik, Patrycja; Cichos, Jakub; Szafert, Sławomir
Use of Stable Amine-Capped Polyynes in the Regioselective Synthesis of Push-Pull Thiophenes.
The Journal of organic chemistry, 2017, 82, 1487-1498
4035052 CIFC10 H11 N O2P 1 21/c 115.6648; 6.225; 9.6874
90; 92.105; 90
944.01Ji, Xiaolei; Gao, Bao; Zhou, Xibing; Liu, Zongjian; Huang, Hanmin
Palladium-Catalyzed Regioselective Hydroaminocarbonylation of Alkynes to α,β-Unsaturated Primary Amides with Ammonium Chloride.
The Journal of organic chemistry, 2018, 83, 10134-10141
4030466 CIFC10 H11 N O3 SP 21 21 216.364; 12.235; 13.112
90; 90; 90
1020.9Martinand-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
4035256 CIFC10 H11 N O3 SP 21 21 215.8934; 9.8741; 17.8348
90; 90; 90
1037.84Kim, Hyeong Rae; Achary, Raghavendra; Lee, Hyeon-Kyu
DBU-Promoted Dynamic Kinetic Resolution in Rh-Catalyzed Asymmetric Transfer Hydrogenation of 5-Alkyl Cyclic Sulfamidate Imines: Stereoselective Synthesis of Functionalized 1,2-Amino Alcohols.
The Journal of organic chemistry, 2018, 83, 11987-11999
4037583 CIFC10 H11 N O3 SP 1 21/n 15.5475; 22.29; 8.951
90; 92.56; 90
1105.7Zhao, Peng; Wu, Xia; Geng, Xiao; Wang, Can; Zhou, You; Wu, Yan-Dong; Wu, An-Xin
I<sub>2</sub>/PhI(OAc)<sub>2</sub> Copromoted Amination Reaction: Synthesis of α-Dicarbonylsulfoximine Derivatives by Incorporating an Intact Dimethyl Sulfoxide.
The Journal of organic chemistry, 2019, 84, 8322-8329
4032902 CIFC10 H11 N O4 SP -17.1934; 7.9479; 9.7888
80.149; 78.645; 89.534
540.42Chang, Meng-Yang; Chen, Han-Yu; Wang, Heui-Sin
Regiocontrolled Synthesis of α-Sulfonylmethyl o-Nitrostyrenes via ZnI2-Mediated Sulfonylation and AgNO2/Pd(PPh3)4-Promoted o-Nitration.
The Journal of organic chemistry, 2017, 82, 10601-10610
4024057 CIFC10 H11 N3P b c a11.3159; 7.5465; 21.013
90; 90; 90
1794.4Brendan J. Liddle; Rosalice M. Silva; Tyler J. Morin; Felipe P. Macedo; Ruchi Shukla; Sergey V. Lindeman; James R. Gardinier
BORAZANs: Tunable Fluorophores Based on 2-(Pyrazolyl)aniline Chelates of Diphenylboron
Journal of Organic Chemistry, 2007, 72, 5637-5646
4022633 CIFC10 H12 Br F2 N3 O3P 21 21 216.4528; 9.5514; 20.5093
90; 90; 90
1264.06Ireneusz Nowak; John F. Cannon; Morris J. Robins
Addition of Difluorocarbene to 3',4'-Unsaturated Nucleosides: Synthesis of 2'-Deoxy Analogues with a 2-Oxabicyclo[3.1.0]hexane Framework
Journal of Organic Chemistry, 2007, 72, 532-537
4024619 CIFC10 H12 Br N O3 SP 1 21 16.2808; 8.2425; 11.701
90; 95.044; 90
603.39Ali Reza Modarresi-Alam; Homeyra Alsadat Amirazizi; Hajar Bagheri; Hamid-Reza Bijanzadeh; Erich Kleinpeter
Dynamic 1H NMR Spectroscopic Study of the Ring Inversion in N-Sulfonyl Morpholines-Studies on N-S Interactions
Journal of Organic Chemistry, 2009, 74, 4740-4746
4025952 CIFC10 H12 Br N3P 1 21/c 18.239; 16.923; 7.936
90; 95.924; 90
1100.6Dirk Meyer; Thomas Strassner
1,2,4-Triazole-Based Tunable Aryl/Alkyl Ionic Liquids
Journal of Organic Chemistry, 2011, 76, 305-308
4035645 CIFC10 H12 Cl N O SP 1 21/c 19.779; 16.269; 7.242
90; 109.31; 90
1087.3Eriksen, Kristina; Ulfkjær, Anne; Sølling, Theis I; Pittelkow, Michael
Benzylic Thio and Seleno Newman-Kwart Rearrangements.
The Journal of organic chemistry, 2018, 83, 10786-10797
4035646 CIFC10 H12 Cl N O SP n a 2111.91; 4.681; 20.27
90; 90; 90
1130Eriksen, Kristina; Ulfkjær, Anne; Sølling, Theis I; Pittelkow, Michael
Benzylic Thio and Seleno Newman-Kwart Rearrangements.
The Journal of organic chemistry, 2018, 83, 10786-10797
4024135 CIFC10 H12 Cl N O3P 1 21 17.1887; 7.5136; 9.5782
90; 96.1275; 90
514.392Nicolas Joubert; Radek Pohl; Blanka Klepetářová; Michal Hocek
Modular and Practical Synthesis of 6-Substituted Pyridin-3-yl C-Nucleosides
Journal of Organic Chemistry, 2007, 72, 6797-6805
4025212 CIFC10 H12 F3 N O4P b c a15.151; 8.909; 17.225
90; 90; 90
2325Alberto Avenoza; Jesús H. Busto; Noelia Canal; Francisco Corzana; Jesús M. Peregrina; Marta Pérez-Fernández; Fernando Rodríguez
Cyclobutane Amino Acid Analogues of Furanomycin Obtained by a Formal [2 + 2] Cycloaddition Strategy Promoted by Methylaluminoxane
Journal of Organic Chemistry, 2010, 75, 545-552
4033630 CIFC10 H12 I N5 O4P 1 21 14.962; 13.1568; 10.7648
90; 96.674; 90
698.01Leonard, Peter; Kondhare, Dasharath; Jentgens, Xenia; Daniliuc, Constantin; Seela, Frank
Nucleobase-Functionalized 5-Aza-7-deazaguanine Ribo- and 2'-Deoxyribonucleosides: Glycosylation, Pd-Assisted Cross-Coupling, and Photophysical Properties.
The Journal of organic chemistry, 2019, 84, 13313-13328
4036650 CIFC10 H12 N2 OP 21 21 214.3708; 13.7544; 15.5815
90; 90; 90
936.72Kerisit, Nicolas; Rouxel, Cédric; Colombel-Rouen, Sophie; Toupet, Loïc; Guillemin, Jean-Claude; Trolez, Yann
Synthesis, Chemistry, and Photochemistry of Methylcyanobutadiyne in the Context of Space Science.
The Journal of organic chemistry, 2016, 81, 3560-3567
4023489 CIFC10 H12 N2 O2 SP 1 21/c 17.5334; 18.0992; 8.462
90; 112.576; 90
1065.37Young Tak Lee; Young Keun Chung
Silver(I)-Catalyzed Facile Synthesis of Pyrazoles From Propargyl N-Sulfonylhydrazones
Journal of Organic Chemistry, 2008, 73, 4698-4701
4028928 CIFC10 H12 N2 O3P 437.9423; 7.9423; 16.974
90; 90; 90
1070.7Fowler, Sarah A.; Luechapanichkul, Rinrada; Blackwell, Helen E.
Synthesis and Characterization of Nitroaromatic Peptoids: Fine Tuning Peptoid Secondary Structure through Monomer Position and Functionality
The Journal of Organic Chemistry, 2009, 74, 1440-1449
4023442 CIFC10 H12 N2 O3 SeP 21 21 218.083; 9.186; 14.877
90; 90; 90
1104.62Dilip K. Tosh; Won Jun Choi; Hea Ok Kim; Yoonji Lee; Shantanu Pal; Xiyan Hou; Jungwon Choi; Sun Choi; Lak Shin Jeong
Stereoselective Synthesis and Conformational Study of Novel 2',3'-Didehydro-2',3'-dideoxy-4'-selenonucleosides
Journal of Organic Chemistry, 2008, 73, 4259-4262
4026769 CIFC10 H12 N2 O5P c a 2112.2038; 4.1403; 22.3872
90; 90; 90
1131.17Stephen A. Glover; Jonathan M. White; Adam A. Rosser; Katherine M. Digianantonio
Structures of N,N-Dialkoxyamides: Pyramidal Anomeric Amides with Low Amidicity
Journal of Organic Chemistry, 2011, 76, 9757-9763
4023443 CIFC10 H12 N2 O5 SeP 21 21 214.95195; 13.432; 16.9083
90; 90; 90
1124.65Dilip K. Tosh; Won Jun Choi; Hea Ok Kim; Yoonji Lee; Shantanu Pal; Xiyan Hou; Jungwon Choi; Sun Choi; Lak Shin Jeong
Stereoselective Synthesis and Conformational Study of Novel 2',3'-Didehydro-2',3'-dideoxy-4'-selenonucleosides
Journal of Organic Chemistry, 2008, 73, 4259-4262
4032148 CIFC10 H12 N2 O8 S2P -16.8561; 7.0999; 7.969
70.08; 88.026; 79.211
358.08Guo, Ya-Fei; Mahmood, Sajid; Xu, Bao-Hua; Yao, Xiao-Qian; He, Hong-Yan; Zhang, Suo-Jiang
Oxidation of Aromatic Aldehydes to Esters: A Sulfate Radical Redox System.
The Journal of organic chemistry, 2017, 82, 1591-1599
4028238 CIFC10 H12 N4 O4P n m a8.055; 6.578; 22.091
90; 90; 90
1170.5Xiao-Jian Li; Jin-Ling Zhang; Yu Geng; Zhong Jin
Nickel-Catalyzed Suzuki-Miyaura Coupling of Heteroaryl Ethers with Arylboronic Acids
Journal of Organic Chemistry, 2013, 78, 5078-5084
4032870 CIFC10 H12 N8P -14.714; 9.5506; 12.6537
80.792; 86.831; 76.742
547.26Ahmed, Basil M.; Rudell, Nicholas A.; Soto, Ixtlazihuatl; Mezei, Gellert
Reaction of Amines with Aldehydes and Ketones Revisited: Access To a Class of Non-Scorpionate Tris(pyrazolyl)methane and Related Ligands.
The Journal of organic chemistry, 2017, 82, 10549-10562
4032650 CIFC10 H12 O2P 6514.7787; 14.7787; 7.6213
90; 90; 120
1441.56Yan, Qiao; Bolte, Benoit; Bai, Yuhua; Banwell, Martin G.; Willis, Anthony C.; Carr, Paul D.
Studies on the Photochemical Rearrangements of Enantiomerically Pure, Polysubstituted, and Variously Annulated Bicyclo[2.2.2]octenones.
The Journal of organic chemistry, 2017, 82, 8008-8022
4032664 CIFC10 H12 O2P 21 21 217.8054; 9.792; 11.058
90; 90; 90
845.168Yan, Qiao; Bolte, Benoit; Bai, Yuhua; Banwell, Martin G.; Willis, Anthony C.; Carr, Paul D.
Studies on the Photochemical Rearrangements of Enantiomerically Pure, Polysubstituted, and Variously Annulated Bicyclo[2.2.2]octenones.
The Journal of organic chemistry, 2017, 82, 8008-8022
4032985 CIFC10 H12 O2P 3211.1863; 11.1863; 6.106
90; 90; 120
661.7Faggyas, Réka J; Calder, Ewen D. D.; Wilson, Claire; Sutherland, Andrew
One-Pot Asymmetric Synthesis of Alkylidene 1-Alkylindan-1-ols Using Brønsted Acid and Palladium Catalysis.
The Journal of organic chemistry, 2017, 82, 11585-11593
4034008 CIFC10 H12 O2P 1 21/c 19.0498; 6.4259; 14.3599
90; 100.944; 90
819.89Lee, Robert; Bashrum, Bryan; Cagle, Ethan C.; Walters, Jillian; Massey, Jake; Zanghi, Monica; Birchfield, Carolyn; French, David; Joy, Jessica; Dos Passos Gomes, Gabriel; Wiget, Paul A.
Electronic Donation or Steric Contraction: A Spectroscopic and Structural Analysis of Medium-Sized Constrained Rings for Potential Long-Range Hyperconjugation.
The Journal of organic chemistry, 2019, 84, 9897-9906
4022506 CIFC10 H12 O2 SP 1 21/n 16.0917; 15.484; 9.968
90; 99.72; 90
926.7Chad A. Snyder; John P. Selegue; Eniolami Dosunmu; Nathan C. Tice; Sean Parkin
C,O-Dialkylation of Meldrum's Acid: Synthesis and Reactivity of 1,3,7,7-Tetramethyl-4H,10H-6,8,9-trioxa-2-thiabenz[f]azulen-5-one
Journal of Organic Chemistry, 2003, 68, 7455-7459
4024650 CIFC10 H12 O3P 1 21/c 18.1057; 10.616; 10.188
90; 90.7; 90
876.6Tony V. Robinson; Daniel Sejer Pedersen; Dennis K. Taylor; Edward R. T. Tiekink
Dihydroxylation of 4-Substituted 1,2-Dioxines: A Concise Route to Branched Erythro Sugars
Journal of Organic Chemistry, 2009, 74, 5093-5096
4020340 CIFC10 H12 O4P 1 21/c 110.265; 5.715; 16.464
90; 105.233; 90
931.9Tory N. Cayzer; Michael N. Paddon-Row; Damian Moran; Alan D. Payne; Michael S. Sherburn; Peter Turner
Intramolecular Diels-Alder Reactions of Ester Linked 1,3,8-Nonatrienes
Journal of Organic Chemistry, 2005, 70, 5561-5570
4033529 CIFC10 H12 O4P 21 21 216.0477; 7.596; 20.0487
90; 90; 90
921Xin, Yangchun; Rodríguez-Santiago, Luís; Sodupe, Mariona; Álvarez-Larena, Angel; Busqué, Félix; Alibés, Ramon
Intramolecular Photocycloaddition of 2(5 H)-Furanones to Temporarily Tethered Terminal Alkenes as a Stereoselective Source of Enantiomerically Pure Polyfunctionalyzed Cyclobutanes.
The Journal of organic chemistry, 2018, 83, 3188-3199
4023109 CIFC10 H12 O4 SP 21 21 217.553; 10.746; 13.435
90; 90; 90
1090.4Xiao-Ying Xu; Zhuo Tang; Yan-Zhao Wang; Shi-Wei Luo; Lin-Feng Cun; Liu-Zhu Gong
Asymmetric Organocatalytic Direct Aldol Reactions of Ketones with α-Keto Acids and Their Application to the Synthesis of 2-Hydroxy-γ-butyrolactones
Journal of Organic Chemistry, 2007, 72, 9905-9913
4035146 CIFC10 H12 O5P 1 21/c 18.392; 19.953; 10.911
90; 94.638; 90
1821Kaufman, Riley H.; Law, Chunyin M.; Simanis, Justin A.; Woodall, Erica L.; Zwick, 3rd, Christian R; Wedler, Henry B.; Wendelboe, Paul; Hamaker, Christopher G.; Goodell, John R.; Tantillo, Dean J.; Mitchell, T. Andrew
Oxidopyrylium-Alkene [5 + 2] Cycloaddition Conjugate Addition Cascade (C<sup>3</sup>) Sequences: Scope, Limitation, and Computational Investigations.
The Journal of organic chemistry, 2018, 83, 9818-9838
4034861 CIFC10 H13 Br2 Cl OP -17.4888; 8.8924; 9.2043
83.085; 86.309; 81.87
601.67Sharp, Phillip P.; Mikusek, Jiri; Ho, Junming; Krenske, Elizabeth H.; Banwell, Martin G.; Coote, Michelle L.; Ward, Jas S.; Willis, Anthony C.
Mechanistic Studies on the Base-Promoted Conversion of Alkoxy-Substituted, Ring-Fused gem-Dihalocyclopropanes into Furans: Evidence for a Process Involving Electrocyclic Ring Closure of a Carbonyl Ylide Intermediate.
The Journal of organic chemistry, 2018, 83, 13678-13690
4037315 CIFC10 H13 Cl N3 O3 PP -18.5724; 9.5217; 10.0248
64.703; 65.55; 85.194
669.1Sabat, Nazarii; Poštová Slavětínská, Lenka; Klepetářová, Blanka; Hocek, Michal
C-H Phosphonation of Pyrrolopyrimidines: Synthesis of Substituted 7- and 9-Deazapurine-8-phosphonate Derivatives.
The Journal of organic chemistry, 2016, 81, 9507-9514
4037316 CIFC10 H13 Cl N3 O3 PP -17.8996; 8.2513; 10.2912
93.736; 97.778; 91.382
662.85Sabat, Nazarii; Poštová Slavětínská, Lenka; Klepetářová, Blanka; Hocek, Michal
C-H Phosphonation of Pyrrolopyrimidines: Synthesis of Substituted 7- and 9-Deazapurine-8-phosphonate Derivatives.
The Journal of organic chemistry, 2016, 81, 9507-9514
4022190 CIFC10 H13 Cl N4 O3P -14.9308; 9.6974; 13.0845
69.191; 84.771; 87.873
582.4Ahmad Basheer; Zvi Rappoport
Substituted 2-Methylene-1,3-oxazolidines, -1,3-thiazolidines, -1,3-benzothiazines, -1,3-oxazines, and Substituted Imidazopyrimidinediones from Cl(CH~2~)~n~NCO and Cl(CH~2~)~n~NCS and Active Methylene Compound
Journal of Organic Chemistry, 2006, 71, 9743-9750
4023844 CIFC10 H13 Cl O2P 21 21 216.0231; 18.026; 18.643
90; 90; 90
2024.1Xin Cheng; Xuefeng Jiang; Yihua Yu; Shengming Ma
Efficient Synthesis of 3-Chloromethyl-2(5H)-furanones and 3-Chloromethyl- 5,6-dihydropyran-2-ones via the PdCl~2~-Catalyzed Chlorocyclocarbonylation of 2,3- or 3,4-Allenols
Journal of Organic Chemistry, 2008, 73, 8960-8965
4034862 CIFC10 H13 Cl3 OP -17.3031; 8.917; 9.1413
81.507; 85.452; 80.354
579.54Sharp, Phillip P.; Mikusek, Jiri; Ho, Junming; Krenske, Elizabeth H.; Banwell, Martin G.; Coote, Michelle L.; Ward, Jas S.; Willis, Anthony C.
Mechanistic Studies on the Base-Promoted Conversion of Alkoxy-Substituted, Ring-Fused gem-Dihalocyclopropanes into Furans: Evidence for a Process Involving Electrocyclic Ring Closure of a Carbonyl Ylide Intermediate.
The Journal of organic chemistry, 2018, 83, 13678-13690
4021620 CIFC10 H13 F N2 O3P 21 21 216.3295; 11.365; 13.908
90; 90; 90
1000.5Zhenhua Sun; Shahadat Ahmed; Larry W. McLaughlin
Syntheses of Pyridine C-Nucleosides as Analogues of the Natural Nucleosides dC and dU
Journal of Organic Chemistry, 2006, 71, 2922-2925
4035104 CIFC10 H13 F N2 O6P 15.9682; 7.005; 13.9039
95.289; 93.695; 91.165
577.4Malek-Adamian, Elise; Patrascu, Mihai Burai; Jana, Sunit Kumar; Martínez-Montero, Saúl; Moitessier, Nicolas; Damha, Masad J.
Adjusting the Structure of 2'-Modified Nucleosides and Oligonucleotides via C4'-α-F or C4'-α-OMe Substitution: Synthesis and Conformational Analysis.
The Journal of organic chemistry, 2018, 83, 9839-9849
4020464 CIFC10 H13 F2 N3 OP 1 21/c 15.3233; 13.1981; 14.7664
90; 96.62; 90
1030.53Graham Sandford; Rachel Slater; Dmitrii S. Yufit; Judith A. K. Howard; Antonio Vong
Tetrahydropyrido[3,4-b]pyrazine Scaffolds from Pentafluoropyridine
Journal of Organic Chemistry, 2005, 70, 7208-7216
4037618 CIFC10 H13 F3 O2P -15.9984; 12.944; 13.935
66.928; 80.968; 83.515
981.5Bugera, Maksym; Trofymchuk, Serhii; Tarasenko, Karen; Zaporozhets, Olga; Pustovit, Yurii; Mykhailiuk, Pavel K.
Deoxofluorination of Aliphatic Carboxylic Acids: a Route to Trifluoromethyl-Substituted Derivatives.
The Journal of organic chemistry, 2019
4020181 CIFC10 H13 F6 O2 SbP -15.4679; 10.7485; 11.6878
89.132; 81.738; 82.582
674.09S. V. Lindeman; I. S. Neretin; M. G. Davlieva; J. K. Kochi
Journal of Organic Chemistry, 2005, 70, 3263-3266
4030412 CIFC10 H13 I O2P n a 2110.1335; 6.3717; 31.1401
90; 90; 90
2010.64Olbrich, Martin; Mayer, Peter; Trauner, Dirk
Synthetic Studies toward Polytwistane Hydrocarbon Nanorods.
The Journal of organic chemistry, 2015, 80, 2042-2055
4030413 CIFC10 H13 I O2P 1 21/c 16.6232; 9.2703; 16.0938
90; 91.834; 90
987.64Olbrich, Martin; Mayer, Peter; Trauner, Dirk
Synthetic Studies toward Polytwistane Hydrocarbon Nanorods.
The Journal of organic chemistry, 2015, 80, 2042-2055
4022048 CIFC10 H13 I O3P 1 21/n 114.117; 12.342; 6.582
90; 98.8; 90
1133.3Alexey Y. Koposov; Rashad R. Karimov; Ivan M. Geraskin; Victor N. Nemykin; Viktor V. Zhdankin
2-Iodylphenol Ethers: Preparation, X-ray Crystal Structure, and Reactivity of New Hypervalent Iodine(V) Oxidizing Reagents
Journal of Organic Chemistry, 2006, 71, 8452-8458
4035647 CIFC10 H13 N O SeP 1 21/n 15.933; 22.0041; 7.9392
90; 100.687; 90
1018.49Eriksen, Kristina; Ulfkjær, Anne; Sølling, Theis I; Pittelkow, Michael
Benzylic Thio and Seleno Newman-Kwart Rearrangements.
The Journal of organic chemistry, 2018, 83, 10786-10797
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
4035033 CIFC10 H13 N O2 SP 41 21 211.19566; 11.19566; 16.25033
90; 90; 90
2036.86Przeslak, Adam D.; Inman, Martyn; Lewis, William; Moody, Christopher J.
Origin of the Thiopyrone CTP-431 "Unexpectedly" Isolated from the Marine Sponge Cacospongia mycofijiensis.
The Journal of organic chemistry, 2018, 83, 10595-10601
4020573 CIFC10 H13 N O3 SP c a 219.932; 12.608; 8.663
90; 90; 90
1084.8Ron W. Darbeau; Noe T. Alvarez; Gregory A. Trahan; Frank R. Fronczek
Investigating the Reaction of N-Carbobenzoxy-O-carbobenzoxy- hydroxylamine with Dimethyl Sulfoxide: Formation of S,S-Dimethyl-N-[(phenylmethoxy)- carbonyl]sulfoximine.
Journal of Organic Chemistry, 2005, 70, 9599-9602
4022675 CIFC10 H13 N O3 SP b c a14.196; 9.713; 15.483
90; 90; 90
2134.9N. C. Misra; K. Panda; H. Ila; H. Junjappa
An Efficient Highly Regioselective Synthesis of 2,3,4-Trisubstituted Pyrroles by Cycloaddition of Polarized Ketene S,S- and N,S- Acetals with Activated Methylene Isocyanides
Journal of Organic Chemistry, 2007, 72, 1246-1251
4020231 CIFC10 H13 N O4P -113.914; 6.448; 6.075
100.19; 97.74; 87.12
531.4Alessia Bacchi; Mirco Costa; Nicola Della Cà; Bartolo Gabriele; Giuseppe Salerno; Silvia Cassoni
Journal of Organic Chemistry, 2005, 70, 4971-4979
4025238 CIFC10 H13 N O4P 1 21 17.1895; 6.1491; 11.6112
90; 106.281; 90
492.73Francis N. Murigi; Gary S. Nichol; Eugene A. Mash
Synthesis of the Conformationally Constrained Tyrosine Analogues, (R)- and (S)-5-Hydroxy-2-aminoindan-2-carboxylic Acids
Journal of Organic Chemistry, 2010, 75, 1293-1296
4020159 CIFC10 H13 N O5P -18.167; 10.762; 11.823
103.069; 95.201; 89.954
1007.9Irishi N. N. Namboothiri; Madhu Ganesh; Shaikh M. Mobin; Miriam Cojocaru
Journal of Organic Chemistry, 2005, 70, 2235-2243

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