Cas no 62403-30-9 (2-Thiophenecarboxamide, N,N-dimethyl-4-phenyl-)
62403-30-9 structure
Product Name:2-Thiophenecarboxamide, N,N-dimethyl-4-phenyl-
CAS No:62403-30-9
MF:C13H13NOS
MW:231.313421964645
CID:446004
PubChem ID:12323283
Update Time:2025-04-19
2-Thiophenecarboxamide, N,N-dimethyl-4-phenyl- Chemical and Physical Properties
Names and Identifiers
-
- 2-Thiophenecarboxamide, N,N-dimethyl-4-phenyl-
- N,N-dimethyl-4-phenylthiophene-2-carboxamide
- SCHEMBL6455459
- DTXSID30488973
- 62403-30-9
-
- Inchi： 1S/C13H13NOS/c1-14(2)13(15)12-8-11(9-16-12)10-6-4-3-5-7-10/h3-9H,1-2H3
- InChI Key： KIOOKGPJFUVUJL-UHFFFAOYSA-N
- SMILES： S1C=C(C=C1C(N(C)C)=O)C1C=CC=CC=1
Computed Properties
- Exact Mass: 231.07189
- Monoisotopic Mass: 231.07178521g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 16
- Rotatable Bond Count: 2
- Complexity: 248
- 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: 3
- Topological Polar Surface Area: 48.6?2
Experimental Properties
- PSA: 20.31
2-Thiophenecarboxamide, N,N-dimethyl-4-phenyl- Related Literature
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Tengfei Yu,Yuehan Wu,Wei Li,Bin Li RSC Adv., 2014,4, 34134-34143
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Hanie Hashtroudi,Ian D. R. Mackinnon J. Mater. Chem. C, 2020,8, 13108-13126
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Liao Xiaoqing,Li Ruiyi,Li Zaijun,Sun Xiulan,Wang Zhouping,Liu Junkang New J. Chem., 2015,39, 5240-5248
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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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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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