Cas no 98547-25-2 (2-Thiophenecarboxamide,3,5-dimethyl-(6CI,9CI))
98547-25-2 structure
Product Name:2-Thiophenecarboxamide,3,5-dimethyl-(6CI,9CI)
CAS No:98547-25-2
MF:C7H9NOS
MW:155.217460393906
CID:801910
Update Time:2023-03-27
2-Thiophenecarboxamide,3,5-dimethyl-(6CI,9CI) Chemical and Physical Properties
Names and Identifiers
-
- 2-Thiophenecarboxamide,3,5-dimethyl-
- 2-Thiophenecarboxamide,3,5-dimethyl-(6CI,9CI)
- 3,5-dimethyl-thiophene-2-carboxylic acid amide
- 2-Thiophenecarboxamide, 3,5-dimethyl-
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- Inchi： 1S/C7H9NOS/c1-4-3-5(2)10-6(4)7(8)9/h3H,1-2H3,(H2,8,9)
- InChI Key： OFLAXLHHXSWDRK-UHFFFAOYSA-N
- SMILES： C1(C(N)=O)SC(C)=CC=1C
Computed Properties
- Exact Mass: 155.04
- Monoisotopic Mass: 155.04
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 10
- Rotatable Bond Count: 1
- Complexity: 149
- 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: 71.3A^2
2-Thiophenecarboxamide,3,5-dimethyl-(6CI,9CI) Related Literature
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David White,Sean R. Stowell Biomater. Sci., 2017,5, 463-474
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Gang Pan,Yi-jie Bao,Jie Xu,Tao Liu,Cheng Liu,Yan-yan Qiu,Xiao-jing Shi,Hui Yu,Ting-ting Jia,Xia Yuan,Ze-ting Yuan,Yi-jun Cao RSC Adv., 2016,6, 42109-42119
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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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Yiding Jiao,Liqun Kang,Jasper Berry-Gair,Kit McColl,Jianwei Li,Haobo Dong,Hao Jiang,Ryan Wang,Furio Corà,Dan J. L. Brett,Ivan P. Parkin J. Mater. Chem. A, 2020,8, 22075-22082
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