Crystallography Open Database

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4026818 CIFC26 H28P 1 21/c 19.799; 34.783; 13.065
90; 124.708; 90
3661Yixi Yang; Michael R. Mannion; Louise N. Dawe; Christina M. Kraml; Robert A. Pascal; Graham J. Bodwell
Synthesis, Crystal Structure, and Resolution of [10](1,6)Pyrenophane: An Inherently Chiral [n]Cyclophane
Journal of Organic Chemistry, 2012, 77, 57-67
4026819 CIFC26 H28P -17.3519; 10.559; 12.901
73.766; 73.458; 80.23
917.3Yixi Yang; Michael R. Mannion; Louise N. Dawe; Christina M. Kraml; Robert A. Pascal; Graham J. Bodwell
Synthesis, Crystal Structure, and Resolution of [10](1,6)Pyrenophane: An Inherently Chiral [n]Cyclophane
Journal of Organic Chemistry, 2012, 77, 57-67
4026820 CIFC28 H18 B F2 N3 S2P n a 2110.776; 12.517; 17.465
90; 90; 90
2355.7Xinfu Zhang; Haibo Yu; Yi Xiao
Replacing Phenyl Ring with Thiophene: An Approach to Longer Wavelength Aza-dipyrromethene Boron Difluoride (Aza-BODIPY) Dyes
Journal of Organic Chemistry, 2012, 77, 669-673
4026821 CIFC48 H28 B2 F4 N6 S8P c a 2112.984; 16.31; 21.56
90; 90; 90
4566Xinfu Zhang; Haibo Yu; Yi Xiao
Replacing Phenyl Ring with Thiophene: An Approach to Longer Wavelength Aza-dipyrromethene Boron Difluoride (Aza-BODIPY) Dyes
Journal of Organic Chemistry, 2012, 77, 669-673
4026822 CIFC20 H27 I O6C 1 2 126.3811; 6.9702; 11.4961
90; 96.058; 90
2102.12Yuxin Qian; Jianhao Feng; Masood Parvez; Chang-Chun Ling
Unexpected Anomeric Selectivity of a 1-C-Arylglycal Donor in Kdo Glycoside Synthesis
Journal of Organic Chemistry, 2012, 77, 96-107
4026823 CIFC20 H27 I O6P 1 21 112.6964; 10.2021; 16.7996
90; 99.8944; 90
2143.68Yuxin Qian; Jianhao Feng; Masood Parvez; Chang-Chun Ling
Unexpected Anomeric Selectivity of a 1-C-Arylglycal Donor in Kdo Glycoside Synthesis
Journal of Organic Chemistry, 2012, 77, 96-107
4026824 CIFC20 H26 O6P 21 21 215.3633; 11.0398; 32.0423
90; 90; 90
1897.22Yuxin Qian; Jianhao Feng; Masood Parvez; Chang-Chun Ling
Unexpected Anomeric Selectivity of a 1-C-Arylglycal Donor in Kdo Glycoside Synthesis
Journal of Organic Chemistry, 2012, 77, 96-107
4026825 CIFC26 H25 N O4 SC 1 c 119.9932; 19.5534; 12.3256
90; 112.147; 90
4463James E. Biggs-Houck; Rebecca L. Davis; Jingqiang Wei; Brandon Q. Mercado; Marilyn M. Olmstead; Dean J. Tantillo; Jared T. Shaw
Carbon-Carbon Bond-Forming Reactions of α-Thioaryl Carbonyl Compounds for the Synthesis of Complex Heterocyclic Molecules
Journal of Organic Chemistry, 2012, 77, 160-172
4026826 CIFC35 H33 Br2 N3 O4P 1 21/c 114.634; 16.3527; 13.0268
90; 92.626; 90
3114.11James E. Biggs-Houck; Rebecca L. Davis; Jingqiang Wei; Brandon Q. Mercado; Marilyn M. Olmstead; Dean J. Tantillo; Jared T. Shaw
Carbon-Carbon Bond-Forming Reactions of α-Thioaryl Carbonyl Compounds for the Synthesis of Complex Heterocyclic Molecules
Journal of Organic Chemistry, 2012, 77, 160-172
4026827 CIFC22 H19 N O4C 1 c 116.7047; 10.6314; 10.7298
90; 112.237; 90
1763.8James E. Biggs-Houck; Rebecca L. Davis; Jingqiang Wei; Brandon Q. Mercado; Marilyn M. Olmstead; Dean J. Tantillo; Jared T. Shaw
Carbon-Carbon Bond-Forming Reactions of α-Thioaryl Carbonyl Compounds for the Synthesis of Complex Heterocyclic Molecules
Journal of Organic Chemistry, 2012, 77, 160-172
4026828 CIFC24 H10 N2C 1 2/c 120.283; 11.0569; 7.3888
90; 100.988; 90
1626.69Paul N. W. Baxter; Abdelaziz Al Ouahabi; Jean-Paul Gisselbrecht; Lydia Brelot; Alexandre Varnek
Electronic, Spectroscopic, and Ion-Sensing Properties of a Dehydro[m]pyrido[14]- and [15]annulene Isomer Library
Journal of Organic Chemistry, 2012, 77, 126-142
4026829 CIFC24 H10 N2P 1 21/c 17.9834; 19.6905; 11.172
90; 113.113; 90
1615.24Paul N. W. Baxter; Abdelaziz Al Ouahabi; Jean-Paul Gisselbrecht; Lydia Brelot; Alexandre Varnek
Electronic, Spectroscopic, and Ion-Sensing Properties of a Dehydro[m]pyrido[14]- and [15]annulene Isomer Library
Journal of Organic Chemistry, 2012, 77, 126-142
4026830 CIFC15 H20 N3 O6 PP 21 21 216.9562; 6.9956; 34.129
90; 90; 90
1660.8Ivan S. Krylov; Valeria M. Zakharova; Michaela Serpi; Ralf Haiges; Boris A. Kashemirov; Charles E. McKenna
Structure of Cyclic Nucleoside Phosphonate Ester Prodrugs: An Inquiry
Journal of Organic Chemistry, 2012, 77, 684-689
4026831 CIFC15 H16 N5 O4 PP 1 21 18.2341; 8.3291; 12.9089
90; 104.66; 90
856.5Ivan S. Krylov; Valeria M. Zakharova; Michaela Serpi; Ralf Haiges; Boris A. Kashemirov; Charles E. McKenna
Structure of Cyclic Nucleoside Phosphonate Ester Prodrugs: An Inquiry
Journal of Organic Chemistry, 2012, 77, 684-689
4026832 CIFC15 H16 N5 O4 PP 1 21 15.7894; 43.207; 6.81
90; 112.184; 90
1577.4Ivan S. Krylov; Valeria M. Zakharova; Michaela Serpi; Ralf Haiges; Boris A. Kashemirov; Charles E. McKenna
Structure of Cyclic Nucleoside Phosphonate Ester Prodrugs: An Inquiry
Journal of Organic Chemistry, 2012, 77, 684-689
4026833 CIFC29 H34 N2 O3 SP 1 21 112.7315; 7.0769; 13.982
90; 93.502; 90
1257.4Yongda Zhang; Sampada Chitale; Navneet Goyal; Guisheng Li; Zhengxu S. Han; Sherry Shen; Shengli Ma; Nelu Grinberg; Heewon Lee; Bruce Z. Lu; Chris H. Senanayake
Asymmetric Synthesis of Sulfinamides Using (-)-Quinine as Chiral Auxiliary
Journal of Organic Chemistry, 2012, 77, 690-695
4026834 CIFC14 H17 Cl N4 O2 SP 1 21/c 110.7148; 20.2974; 7.5927
90; 104.928; 90
1595.55Gwenaelle Bouscary-Deforges; Agnes Bombrun; John Kallikat Augustine; Gérald Bernardinelli; Anna Quattropani
Regioselective Synthesis of 2,8-Disubstituted 4-Aminopyrido[3,2-d]pyrimidine-6-carboxylic Acid Methyl Ester Compounds
Journal of Organic Chemistry, 2012, 77, 243-252
4026835 CIFC14 H17 Cl N4 O2 SP 1 21/n 17.4207; 17.8547; 11.9918
90; 100.761; 90
1560.91Gwenaelle Bouscary-Deforges; Agnes Bombrun; John Kallikat Augustine; Gérald Bernardinelli; Anna Quattropani
Regioselective Synthesis of 2,8-Disubstituted 4-Aminopyrido[3,2-d]pyrimidine-6-carboxylic Acid Methyl Ester Compounds
Journal of Organic Chemistry, 2012, 77, 243-252
4026836 CIFC17 H16 O4P -110.0851; 10.1437; 15.5003
71.158; 71.357; 87.168
1419.4Leire Arias; Yosu Vara; Fernando P. Cossío
Regioselective Preparation of Benzo[b]furans from Phenols and α-Bromoketones
Journal of Organic Chemistry, 2012, 77, 266-275
4026837 CIFC17 H16 O4P -17.2747; 8.8758; 11.9601
109.342; 105.211; 92.871
695.13Leire Arias; Yosu Vara; Fernando P. Cossío
Regioselective Preparation of Benzo[b]furans from Phenols and α-Bromoketones
Journal of Organic Chemistry, 2012, 77, 266-275
4026838 CIFC26 H21 Cl N2 O4P -110.432; 10.465; 11.533
90.692; 108.767; 106.266
1137.2Yi-Bo Nie; Long Wang; Ming-Wu Ding
Synthesis of 1,2,4,5-Tetrasubstituted Imidazoles by a Sequential Aza-Wittig/Michael/Isomerization Reaction
Journal of Organic Chemistry, 2012, 77, 696-700
4026839 CIFC14 H11 N O3C 1 2/c 124.35; 4.8391; 19.731
90; 109.888; 90
2186.3Weihua Chen; Eric B. Twum; Linlin Li; Brian D. Wright; Peter L. Rinaldi; Yi Pang
Rotational Energy Barrier of 2-(2',6'-Dihydroxyphenyl)benzoxazole: A Case Study by NMR
Journal of Organic Chemistry, 2012, 77, 285-290
4026840 CIFC13 H9 N O3P 1 21/c 116.301; 4.863; 13.818
90; 101.652; 90
1072.8Weihua Chen; Eric B. Twum; Linlin Li; Brian D. Wright; Peter L. Rinaldi; Yi Pang
Rotational Energy Barrier of 2-(2',6'-Dihydroxyphenyl)benzoxazole: A Case Study by NMR
Journal of Organic Chemistry, 2012, 77, 285-290
4026841 CIFC23 H24 Cl2 N2 O4P 21 21 216.959; 17.159; 19.174
90; 90; 90
2289.6Xianyou Peng; Peijun Li; Yian Shi
Synthesis of (+)-Ambrisentan via Chiral Ketone-Catalyzed Asymmetric Epoxidation
Journal of Organic Chemistry, 2012, 77, 701-703
4026842 CIFC66 H56R -3 :H27.8608; 27.8608; 16.1433
90; 90; 120
10852Bharat Kumar; Christoph E. Strasser; Benjamin T. King
t-Butyl Biphenylation of o-Dibromoarenes: A Route to Soluble Polycyclic Aromatic Hydrocarbons
Journal of Organic Chemistry, 2012, 77, 311-316
4026843 CIFC68 H80 OP 1 21/c 110.3497; 18.0455; 28.4735
90; 96.591; 90
5282.72Bharat Kumar; Christoph E. Strasser; Benjamin T. King
t-Butyl Biphenylation of o-Dibromoarenes: A Route to Soluble Polycyclic Aromatic Hydrocarbons
Journal of Organic Chemistry, 2012, 77, 311-316
4026844 CIFC82 H121 Li2 O5.5 ZrP b c a24.3175; 22.5604; 27.6744
90; 90; 90
15182.5Bharat Kumar; Christoph E. Strasser; Benjamin T. King
t-Butyl Biphenylation of o-Dibromoarenes: A Route to Soluble Polycyclic Aromatic Hydrocarbons
Journal of Organic Chemistry, 2012, 77, 311-316
4026845 CIFC84 H82 Br2P -114.406; 15.0572; 15.9486
72.458; 77.005; 78.846
3184.6Bharat Kumar; Christoph E. Strasser; Benjamin T. King
t-Butyl Biphenylation of o-Dibromoarenes: A Route to Soluble Polycyclic Aromatic Hydrocarbons
Journal of Organic Chemistry, 2012, 77, 311-316
4026846 CIFC27 H30 Cl2 N O P PdP 21 21 218.9649; 10.4999; 27.225
90; 90; 90
2562.7Étienne Bélanger; Marie-France Pouliot; Marc-André Courtemanche; Jean-François Paquin
Design, Synthesis, and Applications of Potential Substitutes of t-Bu-Phosphinooxazoline in Pd-Catalyzed Asymmetric Transformations and Their Use for the Improvement of the Enantioselectivity in the Pd-Catalyzed Allylation Reaction of Fluorinated Allyl Enol Carbonates
Journal of Organic Chemistry, 2012, 77, 317-331
4026847 CIFC20 H20 S2P 1 21/c 116.6382; 13.2364; 15.3904
90; 97.49; 90
3360.5Vasily A. Migulin; Michael M. Krayushkin; Valery A. Barachevsky; Olga I. Kobeleva; Tatyana M. Valova; Konstantin A. Lyssenko
Synthesis and Characterization of Nonsymmetric Cyclopentene-Based Dithienylethenes
Journal of Organic Chemistry, 2012, 77, 332-340
4026848 CIFC20 H20 S2P 1 21/c 18.3268; 13.2672; 15.4463
90; 97.4242; 90
1692.1Vasily A. Migulin; Michael M. Krayushkin; Valery A. Barachevsky; Olga I. Kobeleva; Tatyana M. Valova; Konstantin A. Lyssenko
Synthesis and Characterization of Nonsymmetric Cyclopentene-Based Dithienylethenes
Journal of Organic Chemistry, 2012, 77, 332-340
4026849 CIFC27 H29 N O9 S2P 21 21 217.0911; 10.8032; 34.798
90; 90; 90
2665.8Wen-Ju Bai; Jason C. Green; Thomas R. R. Pettus
Total Syntheses of ent-Heliespirones A and C
Journal of Organic Chemistry, 2012, 77, 379-387
4026850 CIFC15 H19 N O5P 1 21 17.0653; 8.3781; 12.8601
90; 105.228; 90
734.51Shanbao Yu; Qing-Qing Huang; Yu Luo; Wei Lu
Total Synthesis of Camptothecin and SN-38
Journal of Organic Chemistry, 2012, 77, 713-717
4026851 CIFC37 H48 O6 SiP 21 21 217.7761; 11.0405; 39.4167
90; 90; 90
3384Sanjay S. Palimkar; Jun'ichi Uenishi; Hiromi Ii
Total Synthesis and Biological Evaluation of (-)-Apicularen A and Its Analogues
Journal of Organic Chemistry, 2012, 77, 388-399
4026852 CIFC18 H18 O2 SeP 1 21/c 19.713; 14.82; 11.4273
90; 108.803; 90
1557.1Badaker M. Laloo; Hormi Mecadon; Md. Rumum Rohman; Iadeishisha Kharbangar; Icydora Kharkongor; Mantu Rajbangshi; Rishanlang Nongkhlaw; Bekington Myrboh
Reaction of Selenium Dioxide with Aromatic Ketones in the Presence of Boron Triflouride Etherate: A Protocol for the Synthesis of Triarylethanones
Journal of Organic Chemistry, 2012, 77, 707-712
4026853 CIFC20 H25 Al OP 1 c 19.5556; 13.4123; 14.4803
90; 107.654; 90
1768.43Kengo Yoshida; Taniyuki Furuyama; Chao Wang; Atsuya Muranaka; Daisuke Hashizume; Shuji Yasuike; Masanobu Uchiyama
Aluminepin: Aluminum Analogues of Borepin and Gallepin
Journal of Organic Chemistry, 2012, 77, 729-732
4026854 CIFC36 H24 O12P 1 21/c 126.5365; 32.739; 17.4054
90; 98.344; 90
14961.4Miroslav Dudič; Ivana Císařová; Josef Michl
Synthesis of Hexadehydrotribenzo[a,e,i][12]annulenes by Acetylene Insertion into an Open-Chain Precursor
Journal of Organic Chemistry, 2012, 77, 68-74
4026855 CIFC16 H16 OP -15.7182; 5.9604; 8.6336
96.773; 92.481; 99.717
287.41Prasad Ganji; Hasim Ibrahim
Deoxygenation of Hydroquinones as a General Route to Norbornane-Fused Aromatic Systems: An Entry into Substituted and Functionalized Dimethano- and Methanoanthracenes
Journal of Organic Chemistry, 2012, 77, 511-518
4026856 CIFC22 H15 Cl N2P 1 21/n 110.668; 7.081; 22.36
90; 93.847; 90
1685Shaukat Ali; Ying-Xiu Li; Saeed Anwar; Fang Yang; Zi-Sheng Chen; Yong-Min Liang
One-Pot Access to Indolo[2,3-b]quinolines by Electrophile-Triggered Cross-Amination/Friedel-Crafts Alkylation of Indoles with 1-(2-Tosylaminophenyl)ketones
Journal of Organic Chemistry, 2012, 77, 424-431
4026857 CIFC50 H56 O8P -111.1092; 12.5174; 16.9785
74.609; 73.57; 78.747
2164.9Sambasivarao Kotha; Arjun S. Chavan; Mobin Shaikh
Diversity-Oriented Approach to Macrocyclic Cyclophane Derivatives by Suzuki-Miyaura Cross-Coupling and Olefin Metathesis as Key Steps
Journal of Organic Chemistry, 2012, 77, 482-489
4026858 CIFC50 H56 O8P -17.2962; 9.4; 16.2416
85.924; 84.034; 72.977
1058.38Sambasivarao Kotha; Arjun S. Chavan; Mobin Shaikh
Diversity-Oriented Approach to Macrocyclic Cyclophane Derivatives by Suzuki-Miyaura Cross-Coupling and Olefin Metathesis as Key Steps
Journal of Organic Chemistry, 2012, 77, 482-489
4026859 CIFC25 H28 O4F d d 27.2615; 23.068; 25.8
90; 90; 90
4321.7Sambasivarao Kotha; Arjun S. Chavan; Mobin Shaikh
Diversity-Oriented Approach to Macrocyclic Cyclophane Derivatives by Suzuki-Miyaura Cross-Coupling and Olefin Metathesis as Key Steps
Journal of Organic Chemistry, 2012, 77, 482-489
4026860 CIFC27 H22 O2P 1 21/c 19.4735; 19.451; 11.74
90; 104.73; 90
2092.2Sambasivarao Kotha; Arjun S. Chavan; Mobin Shaikh
Diversity-Oriented Approach to Macrocyclic Cyclophane Derivatives by Suzuki-Miyaura Cross-Coupling and Olefin Metathesis as Key Steps
Journal of Organic Chemistry, 2012, 77, 482-489
4026861 CIFC54 H44 O4P 1 21/c 19.4276; 17.4034; 24.8191
90; 97.203; 90
4039.99Sambasivarao Kotha; Arjun S. Chavan; Mobin Shaikh
Diversity-Oriented Approach to Macrocyclic Cyclophane Derivatives by Suzuki-Miyaura Cross-Coupling and Olefin Metathesis as Key Steps
Journal of Organic Chemistry, 2012, 77, 482-489
4026862 CIFC23 H25 Cl O4P 1 21 112.4209; 5.64; 14.3079
90; 96.562; 90
995.8Jacqueline Jiménez; Aitor Landa; Aitziber Lizarraga; Miguel Maestro; Antonia Mielgo; Mikel Oiarbide; Irene Velilla; Claudio Palomo
Enantio- and Diastereoselective Organocatalytic α-Alkylation of Aldehydes with 3-Substituted 2-(Bromomethyl)acrylates
Journal of Organic Chemistry, 2012, 77, 747-753
4026863 CIFC41 H51.17 N5 O14.33 P2.5R 3 :H30.4865; 30.4865; 12.0383
90; 90; 120
9689.7Vicente Martí-Centelles; M. Isabel Burguete; Francisco Galindo; M. Angeles Izquierdo; D. Krishna Kumar; Andrew J.P. White; Santiago V. Luis; Ramón Vilar
Fluorescent Acridine-Based Receptors for H2PO4-
Journal of Organic Chemistry, 2012, 77, 490-500
4026864 CIFC12 H24 B2 O4P 1 21/c 110.2834; 7.4809; 10.1672
90; 110.478; 90
732.73Christian Kleeberg; Andrew G. Crawford; Andrei S. Batsanov; Paul Hodgkinson; David C. Apperley; Man Sing Cheung; Zhenyang Lin; Todd B. Marder
Spectroscopic and Structural Characterization of the CyNHC Adduct of B2pin2 in Solution and in the Solid State
Journal of Organic Chemistry, 2012, 77, 785-789
4026865 CIFC34 H56 B2 N2 O4P 1 21/c 110.3682; 16.4505; 19.7145
90; 91.028; 90
3362Christian Kleeberg; Andrew G. Crawford; Andrei S. Batsanov; Paul Hodgkinson; David C. Apperley; Man Sing Cheung; Zhenyang Lin; Todd B. Marder
Spectroscopic and Structural Characterization of the CyNHC Adduct of B2pin2 in Solution and in the Solid State
Journal of Organic Chemistry, 2012, 77, 785-789
4026866 CIFC28 H60 B O4 PP 1 2/n 116.6584; 10.492; 19.4579
90; 112.753; 90
3136.2Christian Kleeberg; Andrew G. Crawford; Andrei S. Batsanov; Paul Hodgkinson; David C. Apperley; Man Sing Cheung; Zhenyang Lin; Todd B. Marder
Spectroscopic and Structural Characterization of the CyNHC Adduct of B2pin2 in Solution and in the Solid State
Journal of Organic Chemistry, 2012, 77, 785-789
4026867 CIFC15 H20 O5P 21 21 215.8808; 11.1665; 21.9865
90; 90; 90
1443.81Jennifer Peed; Iwan R. Davies; Lucy R. Peacock; James E. Taylor; Gabriele Kociok-Köhn; Steven D. Bull
Dihydroxylation-Based Approach for the Asymmetric Syntheses of Hydroxy-γ-butyrolactones
Journal of Organic Chemistry, 2012, 77, 543-555
4026868 CIFC17 H18 O5C 1 2 123.18; 5.353; 12.036
90; 90.93; 90
1493Christopher J. Bartlett; David P. Day; Yohan Chan; Steven M. Allin; Michael J. McKenzie; Alexandra M. Z. Slawin; Philip C. Bulman Page
Enantioselective Total Synthesis of (+)-Scuteflorin A Using Organocatalytic Asymmetric Epoxidation
Journal of Organic Chemistry, 2012, 77, 772-774
4026869 CIFC27 H23 Br N2 O3 S2P 21 21 219.5539; 11.8301; 22.8098
90; 90; 90
2578.05Alma Viso; Roberto Fernández de la Pradilla; Mercedes Ureña; Robert H. Bates; Miguel A. del Águila; Ignacio Colomer
An Approach to the Stereoselective Synthesis of Enantiopure Dihydropyrroles and Aziridines from a Common Sulfinyl-Sulfinamide Intermediate
Journal of Organic Chemistry, 2012, 77, 525-542
4026870 CIFC11 H18 O2P b c a8.9673; 18.5999; 24.5171
90; 90; 90
4089.23Hung-Yi Lee; Chin-Kang Sha
Stereoselective Total Synthesis of (\±)-Peribysin E
Journal of Organic Chemistry, 2012, 77, 598-605
4026871 CIFC21 H34 O4 SiP -16.5778; 9.9611; 16.789
85.436; 84.148; 83.784
1085.3Hung-Yi Lee; Chin-Kang Sha
Stereoselective Total Synthesis of (\±)-Peribysin E
Journal of Organic Chemistry, 2012, 77, 598-605
4026872 CIFC22 H38 O4 SiP -16.8505; 9.2832; 18.4577
77.288; 84.422; 84.451
1136.18Hung-Yi Lee; Chin-Kang Sha
Stereoselective Total Synthesis of (\±)-Peribysin E
Journal of Organic Chemistry, 2012, 77, 598-605
4026873 CIFC16 H23 Cl3 O4P 4/n :219.8762; 19.8762; 10.665
90; 90; 90
4213.4Hung-Yi Lee; Chin-Kang Sha
Stereoselective Total Synthesis of (\±)-Peribysin E
Journal of Organic Chemistry, 2012, 77, 598-605
4026874 CIFC12 H16 N4 O4P 1 21/c 18.402; 11.908; 13.721
90; 114.964; 90
1244.5Feng Wu; Li-Hui Wu; Xin Xiao; Yun-Qian Zhang; Sai-Feng Xue; Zhu Tao; Anthony I. Day
Locating the Cyclopentano Cousins of the Cucurbit[n]uril Family
Journal of Organic Chemistry, 2012, 77, 606-611
4026875 CIFC11 H14 N4 O4P n m a12.4218; 11.3954; 8.1359
90; 90; 90
1151.65Feng Wu; Li-Hui Wu; Xin Xiao; Yun-Qian Zhang; Sai-Feng Xue; Zhu Tao; Anthony I. Day
Locating the Cyclopentano Cousins of the Cucurbit[n]uril Family
Journal of Organic Chemistry, 2012, 77, 606-611
4026876 CIFC13 H18 N4 O6P n n 210.0897; 10.5987; 6.5148
90; 90; 90
696.68Feng Wu; Li-Hui Wu; Xin Xiao; Yun-Qian Zhang; Sai-Feng Xue; Zhu Tao; Anthony I. Day
Locating the Cyclopentano Cousins of the Cucurbit[n]uril Family
Journal of Organic Chemistry, 2012, 77, 606-611
4026877 CIFC135 H258 Cl6 K6 N60 O87P 1 21/c 120.2298; 33.2253; 29.4252
90; 95.186; 90
19696.9Feng Wu; Li-Hui Wu; Xin Xiao; Yun-Qian Zhang; Sai-Feng Xue; Zhu Tao; Anthony I. Day
Locating the Cyclopentano Cousins of the Cucurbit[n]uril Family
Journal of Organic Chemistry, 2012, 77, 606-611
4026878 CIFC116 H208 N48 O61P 1 21/c 112.6912; 12.5739; 23.0762
90; 98.67; 90
3640.4Feng Wu; Li-Hui Wu; Xin Xiao; Yun-Qian Zhang; Sai-Feng Xue; Zhu Tao; Anthony I. Day
Locating the Cyclopentano Cousins of the Cucurbit[n]uril Family
Journal of Organic Chemistry, 2012, 77, 606-611
4026879 CIFC12 H4 F18 N4 OP -19.0544; 9.442; 11.9252
92.914; 101.077; 108.534
941.73Igor I. Gerus; Roman X. Mironetz; Ivan S. Kondratov; Andrei V. Bezdudny; Yurii V. Dmytriv; Oleg V. Shishkin; Viktoriia S. Starova; Olga A. Zaporozhets; Andrey A. Tolmachev; Pavel K. Mykhailiuk
"Reported, but Still Unknown." A Closer Look into 3,4-Bis- and 3,4,5-Tris(trifluoromethyl)pyrazoles
Journal of Organic Chemistry, 2012, 77, 47-56
4026880 CIFC5 H2 F6 N2P 1 21/n 116.463; 12.5288; 21.5826
90; 111.568; 90
4140Igor I. Gerus; Roman X. Mironetz; Ivan S. Kondratov; Andrei V. Bezdudny; Yurii V. Dmytriv; Oleg V. Shishkin; Viktoriia S. Starova; Olga A. Zaporozhets; Andrey A. Tolmachev; Pavel K. Mykhailiuk
"Reported, but Still Unknown." A Closer Look into 3,4-Bis- and 3,4,5-Tris(trifluoromethyl)pyrazoles
Journal of Organic Chemistry, 2012, 77, 47-56
4026881 CIFC27 H26 Br N OP 1 21 19.4945; 10.87; 12.264
90; 111.75; 90
1175.6Kyoung Hee Kang; Junghwan Do; Yong Sun Park
Asymmetric Synthesis oftrans-2,3-Disubstituted Indoline Derivatives
Journal of Organic Chemistry, 2012, 77, 808-812
4026882 CIFC19 H24 O4P 1 21/c 17.8863; 23.7456; 9.0571
90; 97.213; 90
1682.65Jens Cordes; Frederick Calo; Katie Anderson; Toni Pfaffeneder; Sylvain Laclef; Andrew J. P. White; Anthony G. M. Barrett
Total Syntheses of Angelicoin A, Hericenone J, and Hericenol A via Migratory Prenyl- and Geranylation-Aromatization Sequences
Journal of Organic Chemistry, 2012, 77, 652-657
4026883 CIFC33 H22 Fe N2 O4P 1 21/c 125.4291; 10.2386; 20.0586
90; 91.039; 90
5221.6Li-Jun Chen; Quan-Jie Li; Jiuming He; Hongwei Tan; Zeper Abliz; Hai-Bo Yang
Design and Construction of Endo-Functionalized Multiferrocenyl Hexagons via Coordination-Driven Self-Assembly and Their Electrochemistry
Journal of Organic Chemistry, 2012, 77, 1148-1153
4026884 CIFC19 H11 Br N2 O3P -18.009; 11.045; 11.59
113.247; 105.854; 97.89
871Gen Zhang; Yaohu Zhang; Jiexi Yan; Ru Chen; Shoulei Wang; Yunxia Ma; Rui Wang
One-Pot Enantioselective Synthesis of Functionalized Pyranocoumarins and 2-Amino-4H-chromenes: Discovery of a Type of Potent Antibacterial Agent
Journal of Organic Chemistry, 2012, 77, 878-888
4026885 CIFC35 H33 Br N4 O2 SP 1 21/c 116.2504; 12.0239; 18.9598
90; 124.038; 90
3069.9Zheng Yang; Mengyao She; Bing Yin; Jihong Cui; Yuze Zhang; Wei Sun; Jianli Li; Zhen Shi
Three Rhodamine-Based "Off-On" Chemosensors with High Selectivity and Sensitivity for Fe3+ Imaging in Living Cells
Journal of Organic Chemistry, 2012, 77, 1143-1147
4026886 CIFC37 H36 N6 O4 SP -19.654; 12.011; 15.321
101.696; 90.916; 100.475
1708.1Zheng Yang; Mengyao She; Bing Yin; Jihong Cui; Yuze Zhang; Wei Sun; Jianli Li; Zhen Shi
Three Rhodamine-Based "Off-On" Chemosensors with High Selectivity and Sensitivity for Fe3+ Imaging in Living Cells
Journal of Organic Chemistry, 2012, 77, 1143-1147
4026887 CIFC36 H36 N4 O3 SP 1 21/n 116.253; 12.018; 16.937
90; 110.58; 90
3097.2Zheng Yang; Mengyao She; Bing Yin; Jihong Cui; Yuze Zhang; Wei Sun; Jianli Li; Zhen Shi
Three Rhodamine-Based "Off-On" Chemosensors with High Selectivity and Sensitivity for Fe3+ Imaging in Living Cells
Journal of Organic Chemistry, 2012, 77, 1143-1147
4026888 CIFC36 H36 Cl3 Fe N4 O3 SP 1 21/n 112.412; 16.298; 17.833
90; 91.209; 90
3606.6Zheng Yang; Mengyao She; Bing Yin; Jihong Cui; Yuze Zhang; Wei Sun; Jianli Li; Zhen Shi
Three Rhodamine-Based "Off-On" Chemosensors with High Selectivity and Sensitivity for Fe3+ Imaging in Living Cells
Journal of Organic Chemistry, 2012, 77, 1143-1147
4026889 CIFC19 H25 N O7P 1 21/n 110.6629; 11.7766; 15.3061
90; 105.025; 90
1856.3Gen Onodera; Mari Suto; Ryo Takeuchi
Iridium-Catalyzed [2+2+2] Cycloaddition of α,ω-Diynes with Isocyanates
Journal of Organic Chemistry, 2012, 77, 908-920
4026890 CIFC13 H17 N O3P 1 21/c 19.3754; 11.161; 11.962
90; 105.572; 90
1205.7Gen Onodera; Mari Suto; Ryo Takeuchi
Iridium-Catalyzed [2+2+2] Cycloaddition of α,ω-Diynes with Isocyanates
Journal of Organic Chemistry, 2012, 77, 908-920
4026891 CIFC21 H23 N O6P 1 21 113.9836; 8.2614; 17.967
90; 99.302; 90
2048.33Gen Onodera; Mari Suto; Ryo Takeuchi
Iridium-Catalyzed [2+2+2] Cycloaddition of α,ω-Diynes with Isocyanates
Journal of Organic Chemistry, 2012, 77, 908-920
4026892 CIFC20 H18 O2P 1 21/c 111.606; 18.287; 7.1396
90; 103.762; 90
1471.8Soo J. Park; Jason R. Price; Matthew H. Todd
Oxidative Arylation of Isochroman
Journal of Organic Chemistry, 2012, 77, 949-955
4026893 CIFC20 H17 Br O2P -19.7507; 10.7237; 24.61
96.602; 96.2797; 107.296
2412.53Soo J. Park; Jason R. Price; Matthew H. Todd
Oxidative Arylation of Isochroman
Journal of Organic Chemistry, 2012, 77, 949-955
4026894 CIFC17 H25 N5 O3 SP -18.4371; 8.7423; 14.5956
105.766; 98.497; 99.551
1000.39Orazio A. Attanasi; Silvia Bartoccini; Gianfranco Favi; Gianluca Giorgi; Francesca Romana Perrulli; Stefania Santeusanio
Powerful Approach to Heterocyclic Skeletal Diversity by Sequential Three-Component Reaction of Amines, Isothiocyanates, and 1,2-Diaza-1,3-dienes
Journal of Organic Chemistry, 2012, 77, 1161-1167
4026895 CIFC19 H13 Br O2P 1 21 18.3746; 5.691; 15.6697
90; 101.539; 90
731.72Jie Chen; Ling Zhou; Chong Kiat Tan; Ying-Yeung Yeung
An Enantioselective Approach toward 3,4-Dihydroisocoumarin through the Bromocyclization of Styrene-type Carboxylic Acids
Journal of Organic Chemistry, 2012, 77, 999-1009
4026896 CIFC15 H14 O2P 1 21/c 110.0497; 9.862; 23.217
90; 96.068; 90
2288.1Jie Chen; Ling Zhou; Chong Kiat Tan; Ying-Yeung Yeung
An Enantioselective Approach toward 3,4-Dihydroisocoumarin through the Bromocyclization of Styrene-type Carboxylic Acids
Journal of Organic Chemistry, 2012, 77, 999-1009
4026897 CIFC38 H54 N4 O2P 1 21/n 111.9253; 20.4021; 13.345
90; 90.039; 90
3246.9Juraj Galeta; Milan Potáček
Substituted Diazatetracyclo[4.4.0.13,10.15,8]dodecanes as Stable Caged Proton Sponges
Journal of Organic Chemistry, 2012, 77, 1010-1017
4026898 CIFC40 H52 N6 O2P -110.1677; 11.5098; 14.9251
89.064; 80.717; 83.191
1711.62Juraj Galeta; Milan Potáček
Substituted Diazatetracyclo[4.4.0.13,10.15,8]dodecanes as Stable Caged Proton Sponges
Journal of Organic Chemistry, 2012, 77, 1010-1017
4026899 CIFC42.25 H63.5 Cl N4 O0.75P n a 2117.9478; 20.838; 10.6397
90; 90; 90
3979.21Juraj Galeta; Milan Potáček
Substituted Diazatetracyclo[4.4.0.13,10.15,8]dodecanes as Stable Caged Proton Sponges
Journal of Organic Chemistry, 2012, 77, 1010-1017
4026900 CIFC66 H98 Cl6 N8 O4P -112.5909; 16.0545; 16.6187
81.534; 74.721; 80.6
3177.8Juraj Galeta; Milan Potáček
Substituted Diazatetracyclo[4.4.0.13,10.15,8]dodecanes as Stable Caged Proton Sponges
Journal of Organic Chemistry, 2012, 77, 1010-1017
4026901 CIFC16 H21 F2 N O3P 1 21/c 16.702; 16.936; 13.275
90; 90.508; 90
1506.7Sara H. Kyne; Jonathan A. L. Miles; Jonathan M. Percy; Kuldip Singh
Executing and Rationalizing the Synthesis of a Difluorinated Analogue of a Ring-Expanded Calystegine B2
Journal of Organic Chemistry, 2012, 77, 991-998
4026902 CIFC15 H19 F2 N O3P c c n11.428; 24.352; 10.474
90; 90; 90
2914.9Sara H. Kyne; Jonathan A. L. Miles; Jonathan M. Percy; Kuldip Singh
Executing and Rationalizing the Synthesis of a Difluorinated Analogue of a Ring-Expanded Calystegine B2
Journal of Organic Chemistry, 2012, 77, 991-998
4026903 CIFC18 H30 O3P -112.6177; 14.0998; 20.0716
85.747; 89.306; 69.962
3345.1Dane Holte; Daniel C. G. Götz; Phil S. Baran
An Approach to Mimicking the Sesquiterpene Cyclase Phase by Nickel-Promoted Diene/Alkyne Cooligomerization
Journal of Organic Chemistry, 2012, 77, 825-842
4026904 CIFC18 H30 O3P -15.5789; 11.6219; 13.0202
94.998; 92.49; 98.515
830.35Dane Holte; Daniel C. G. Götz; Phil S. Baran
An Approach to Mimicking the Sesquiterpene Cyclase Phase by Nickel-Promoted Diene/Alkyne Cooligomerization
Journal of Organic Chemistry, 2012, 77, 825-842
4026905 CIFC26 H26 Br2 N2 O3P 1 21/c 112.4712; 12.558; 15.8397
90; 96.244; 90
2465.99Dane Holte; Daniel C. G. Götz; Phil S. Baran
An Approach to Mimicking the Sesquiterpene Cyclase Phase by Nickel-Promoted Diene/Alkyne Cooligomerization
Journal of Organic Chemistry, 2012, 77, 825-842
4026906 CIFC16 H12 Br N O3P 1 21 17.9944; 6.2207; 14.801
90; 103.384; 90
716.07Liang-Qiu Lu; Zhi-Hui Ming; Jing An; Chao Li; Jia-Rong Chen; Wen-Jing Xiao
Enantioselective Cascade Reactions of Stable Sulfur Ylides and Nitroolefins through an Axial-to-Central Chirality Transfer Strategy
Journal of Organic Chemistry, 2012, 77, 1072-1080
4026907 CIFC24 H14 Cl N O3P -17.5; 10.077; 12.947
73.78; 84.08; 80.89
925.9Yun Liu; Jin-Wei Sun
Copper(II)-Catalyzed Synthesis of Benzo[f]pyrido[1,2-a]indole-6,11-dione Derivatives via Naphthoquinone Difunctionalization Reaction
Journal of Organic Chemistry, 2012, 77, 1191-1197
4026908 CIFC47 H63 Cl2 F3 N3 O4 P Pd SP -110.6924; 12.4945; 18.4352
102.594; 96.5551; 96.1075
2365.9Bennett J. Tardiff; Robert McDonald; Michael J. Ferguson; Mark Stradiotto
Rational and Predictable Chemoselective Synthesis of Oligoamines via Buchwald-Hartwig Amination of (Hetero)Aryl Chlorides Employing Mor-DalPhos
Journal of Organic Chemistry, 2012, 77, 1056-1071
4026909 CIFC30 H42 N O PP -110.2665; 11.0209; 12.1446
67.6814; 81.459; 79.9256
1246.48Bennett J. Tardiff; Robert McDonald; Michael J. Ferguson; Mark Stradiotto
Rational and Predictable Chemoselective Synthesis of Oligoamines via Buchwald-Hartwig Amination of (Hetero)Aryl Chlorides Employing Mor-DalPhos
Journal of Organic Chemistry, 2012, 77, 1056-1071
4026910 CIFC16 H13 Cl N4 O2C 1 2/c 130.931; 7.4285; 14.506
90; 113.436; 90
3058.1Melissa L. McIntosh; Ryne C. Johnston; Ommidala Pattawong; Bradley O. Ashburn; Michael R. Naffziger; Paul Ha-Yeon Cheong; Rich G. Carter
Synthesis and Computational Analysis of Densely Functionalized Triazoles Using o-Nitrophenylalkynes
Journal of Organic Chemistry, 2012, 77, 1101-1112
4026911 CIFC23 H18 N4 O4P 1 21/c 19.3017; 9.7642; 21.914
90; 92.503; 90
1988.4Melissa L. McIntosh; Ryne C. Johnston; Ommidala Pattawong; Bradley O. Ashburn; Michael R. Naffziger; Paul Ha-Yeon Cheong; Rich G. Carter
Synthesis and Computational Analysis of Densely Functionalized Triazoles Using o-Nitrophenylalkynes
Journal of Organic Chemistry, 2012, 77, 1101-1112
4026912 CIFC26.5 H30 O2P 1 21/c 123.192; 9.251; 21.285
90; 112.12; 90
4230.6Sarah J. Ryan; Andreas Stasch; Michael N. Paddon-Row; David W. Lupton
Synthetic and Quantum Mechanical Studies into theN-Heterocyclic Carbene Catalyzed (4 + 2) Cycloaddition
Journal of Organic Chemistry, 2012, 77, 1113-1124
4026913 CIFC27 H34 N2 O2 SC 1 2 118.913; 6.478; 22.834
90; 110.889; 90
2614Zhihua Liu; Sukeshi J. Mehta; Kwang-Soo Lee; Bryan Grossman; Hongchang Qu; Xuyuan Gu; Gary S. Nichol; Victor J. Hruby
Thio-Claisen Rearrangement Used in Preparing Anti-β-Functionalized γ,δ-Unsaturated Amino Acids: Scope and Limitations
Journal of Organic Chemistry, 2012, 77, 1289-1300
4026914 CIFC13 H10 F3 N3 O2P 1 21/c 116.2577; 10.796; 7.2438
90; 93.455; 90
1269.11Mark A. Honey; Raffaele Pasceri; William Lewis; Christopher J. Moody
Diverse Trifluoromethyl Heterocycles from a Single Precursor
Journal of Organic Chemistry, 2012, 77, 1396-1405
4026915 CIFC13 H13 Br F3 N O5P -17.1571; 8.4227; 13.3083
98.186; 100.888; 96.356
771.93Mark A. Honey; Raffaele Pasceri; William Lewis; Christopher J. Moody
Diverse Trifluoromethyl Heterocycles from a Single Precursor
Journal of Organic Chemistry, 2012, 77, 1396-1405
4026916 CIFC13 H11 Br F3 N O4P -19.2599; 9.4971; 9.9419
70.159; 62.394; 83.144
728Mark A. Honey; Raffaele Pasceri; William Lewis; Christopher J. Moody
Diverse Trifluoromethyl Heterocycles from a Single Precursor
Journal of Organic Chemistry, 2012, 77, 1396-1405
4026917 CIFC14 H14 F3 N O5P 1 21/n 19.5898; 15.653; 11.0541
90; 115.637; 90
1496Mark A. Honey; Raffaele Pasceri; William Lewis; Christopher J. Moody
Diverse Trifluoromethyl Heterocycles from a Single Precursor
Journal of Organic Chemistry, 2012, 77, 1396-1405

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