Cas no 62187-70-6 (Cyclopropanecarboxamide, N-(5-methyl-2-thienyl)-)
62187-70-6 structure
Product Name:Cyclopropanecarboxamide, N-(5-methyl-2-thienyl)-
CAS No:62187-70-6
MF:C9H11NOS
MW:181.254740953445
CID:455079
PubChem ID:23341643
Update Time:2025-04-19
Cyclopropanecarboxamide, N-(5-methyl-2-thienyl)- Chemical and Physical Properties
Names and Identifiers
-
- Cyclopropanecarboxamide, N-(5-methyl-2-thienyl)-
- N-(5-methylthiophen-2-yl)cyclopropanecarboxamide
- DTXSID10633181
- SCHEMBL11462094
- 62187-70-6
-
- Inchi： 1S/C9H11NOS/c1-6-2-5-8(12-6)10-9(11)7-3-4-7/h2,5,7H,3-4H2,1H3,(H,10,11)
- InChI Key： ZBQLWGDJOLHBNG-UHFFFAOYSA-N
- SMILES： S1C(C)=CC=C1NC(C1CC1)=O
Computed Properties
- Exact Mass: 181.05623
- Monoisotopic Mass: 181.05613515g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 12
- Rotatable Bond Count: 2
- Complexity: 191
- 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
- XLogP3: 2
- Topological Polar Surface Area: 57.3?2
Experimental Properties
- PSA: 29.1
Cyclopropanecarboxamide, N-(5-methyl-2-thienyl)- Related Literature
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Eric Besson,Stéphane Gastaldi,Emily Bloch,Selma Aslan,Hakim Karoui,Olivier Ouari,Micael Hardy Analyst, 2019,144, 4194-4203
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Denis V. Korchagin,Elena A. Yureva,Alexander V. Akimov,Eugenii Ya. Misochko,Gennady V. Shilov,Artem D. Talantsev,Roman B. Morgunov,Alexander A. Shakin,Sergey M. Aldoshin,Boris S. Tsukerblat Dalton Trans., 2017,46, 7540-7548
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Jing Yu,Yu-Qi Lyu,Jiapeng Liu,Mohammed B. Effat,Junxiong Wu J. Mater. Chem. A, 2019,7, 17995-18002
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Hanie Hashtroudi,Ian D. R. Mackinnon J. Mater. Chem. C, 2020,8, 13108-13126
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Amandine Altmayer-Henzien,Valérie Declerck,David J. Aitken,Ewen Lescop,Denis Merlet,Jonathan Farjon Org. Biomol. Chem., 2013,11, 7611-7615
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