Cas no 918793-08-5 (N-(4-Oxocyclohexyl)cyclopropanecarboxamide)
918793-08-5 structure
Product Name:N-(4-Oxocyclohexyl)cyclopropanecarboxamide
CAS No:918793-08-5
MF:C10H15NO2
MW:181.231602907181
CID:771041
Update Time:2023-08-03
N-(4-Oxocyclohexyl)cyclopropanecarboxamide Chemical and Physical Properties
Names and Identifiers
-
- Cyclopropanecarboxamide, N-(4-oxocyclohexyl)-
- N-(4-oxocyclohexyl)cyclopropanecarboxamide
- KOLCXBCEUFFKPJ-UHFFFAOYSA-N
- cyclopropanecarboxylic acid(4-oxocyclohexyl)amide
- N-(4-Oxocyclohexyl)cyclopropanecarboxamide
-
- Inchi： 1S/C10H15NO2/c12-9-5-3-8(4-6-9)11-10(13)7-1-2-7/h7-8H,1-6H2,(H,11,13)
- InChI Key： KOLCXBCEUFFKPJ-UHFFFAOYSA-N
- SMILES： O=C(C1CC1)NC1CCC(CC1)=O
Computed Properties
- Exact Mass: 181.11
- Monoisotopic Mass: 181.11
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 13
- Rotatable Bond Count: 2
- Complexity: 223
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 46.2
N-(4-Oxocyclohexyl)cyclopropanecarboxamide Related Literature
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Teresita Carrillo-Hernández,Philippe Schaeffer,Pierre Albrecht Chem. Commun., 2001, 1976-1977
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Chongyang Zhu,Xiaojia Bian,Xin Jia,Ning Tang,Yongqiang Cheng Food Funct., 2020,11, 10635-10644
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Raktani Bikshapathi,Sai Prathima Parvathaneni,Vaidya Jayathirtha Rao Green Chem., 2017,19, 4446-4450
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P. K. Wawrzyniak,M. T. P. Beerepoot,H. J. M. de Groot,F. Buda Phys. Chem. Chem. Phys., 2011,13, 10270-10279
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Jingquan Liu,Huiyun Liu,Zhongfan Jia,Volga Bulmus,Thomas P. Davis Chem. Commun., 2008, 6582-6584
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