Cas no 8024-26-8 (4-Cyano-1H-pyrrole-2-carboxylic Acid)
8024-26-8 structure
Product Name:4-Cyano-1H-pyrrole-2-carboxylic Acid
CAS No:8024-26-8
MF:C6H4N2O2
MW:136.108160972595
CID:727782
Update Time:2023-08-02
4-Cyano-1H-pyrrole-2-carboxylic Acid Chemical and Physical Properties
Names and Identifiers
-
- Oils, Helichrysum
- HELICHRYSUM OIL
- 4-cyano-1H-pyrrole-2-carboxylic Acid
- 4-Cyanopyrrole-2-carboxylic acid
- 1H-Pyrrole-2-carboxylic acid, 4-cyano-
- 4-cyanopyrrolecarboxylic acid
- BBL025905
- STL294800
- VP60092
- AB0032261
- X5552
- 4-Cyano-1H-pyrrole-2-carboxylic acid, AldrichCPR
- Z1335657658
- 4-Cyano-1H-pyrrole-2-carboxylic Acid
-
- Inchi： 1S/C6H4N2O2/c7-2-4-1-5(6(9)10)8-3-4/h1,3,8H,(H,9,10)
- InChI Key： SAEZQFNKTQKVSM-UHFFFAOYSA-N
- SMILES： OC(C1=CC(C#N)=CN1)=O
Computed Properties
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 10
- Rotatable Bond Count: 1
- Complexity: 193
- XLogP3: 0.3
- Topological Polar Surface Area: 76.9
4-Cyano-1H-pyrrole-2-carboxylic Acid Related Literature
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Yaqing Liu,Jiangtao Ren,Jing Li,Jiyang Liu,Erkang Wang Chem. Commun., 2012,48, 802-804
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Quan Xiang,Yiqin Chen,Zhiqin Li,Kaixi Bi,Guanhua Zhang,Huigao Duan Nanoscale, 2016,8, 19541-19550
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Michael Kappl,Paul M. Young,Daniela Traini,Sanyog Jain RSC Adv., 2016,6, 25789-25798
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Jingquan Liu,Huiyun Liu,Zhongfan Jia,Volga Bulmus,Thomas P. Davis Chem. Commun., 2008, 6582-6584
-
Teresita Carrillo-Hernández,Philippe Schaeffer,Pierre Albrecht Chem. Commun., 2001, 1976-1977
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