Cas no 299418-37-4 (Formamide,N-(2-methyl-6-benzothiazolyl)-)
299418-37-4 structure
Product Name:Formamide,N-(2-methyl-6-benzothiazolyl)-
CAS No:299418-37-4
MF:C9H8N2OS
MW:192.237620353699
CID:249336
PubChem ID:676577
Update Time:2025-04-19
Formamide,N-(2-methyl-6-benzothiazolyl)- Chemical and Physical Properties
Names and Identifiers
-
- Formamide,N-(2-methyl-6-benzothiazolyl)-
- Formamide, N-(2-methyl-6-benzothiazolyl)- (9CI)
- N-(2-methyl-6-benzothiazolyl)Formamide
- N-(2-methyl-1,3-benzothiazol-6-yl)formamide
- 299418-37-4
- SCHEMBL13075992
- AKOS014312244
- FT-0736414
-
- Inchi： 1S/C9H8N2OS/c1-6-11-8-3-2-7(10-5-12)4-9(8)13-6/h2-5H,1H3,(H,10,12)
- InChI Key： CBELFOCJXFZCHH-UHFFFAOYSA-N
- SMILES： S1C(C)=NC2C=CC(=CC1=2)NC=O
Computed Properties
- Exact Mass: 192.03600
- Monoisotopic Mass: 192.03573406g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 13
- Rotatable Bond Count: 1
- Complexity: 200
- 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: 70.2?2
Experimental Properties
- PSA: 70.23000
- LogP: 2.88190
Formamide,N-(2-methyl-6-benzothiazolyl)- Related Literature
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Huading Zhang,Lee R. Moore,Maciej Zborowski,P. Stephen Williams,Shlomo Margel,Jeffrey J. Chalmers Analyst, 2005,130, 514-527
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Hanie Hashtroudi,Ian D. R. Mackinnon J. Mater. Chem. C, 2020,8, 13108-13126
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Tao Wang,Yangyang Liu,Yue Deng,Hongbo Fu,Jianmin Chen Environ. Sci.: Nano, 2018,5, 1821-1833
-
Yaling Zhang,Chunhui Dai,Shiwei Zhou,Bin Liu Chem. Commun., 2018,54, 10092-10095
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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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