Cas no 101337-92-2 (2-Benzothiazolamine,5-chloro-6-fluoro-)
101337-92-2 structure
Product Name:2-Benzothiazolamine,5-chloro-6-fluoro-
CAS No:101337-92-2
MF:C7H4ClFN2S
MW:202.636462211609
CID:138303
PubChem ID:15644612
Update Time:2025-04-19
2-Benzothiazolamine,5-chloro-6-fluoro- Chemical and Physical Properties
Names and Identifiers
-
- 2-Benzothiazolamine,5-chloro-6-fluoro-
- 6-CHLORO-5-FLUOROBENZIMIDAZOLE-2-THIOL
- 2-amino-5-chloro-6-fluoro benzothiazole
- 5-chloro-6-fluoro-1,3-benzothiazol-2-amine
- 5-CHLORO-6-FLUOROBENZIMIDAZOLE-2-THIOLE
- 5-chloro-6-fluoro-benzothiazol-2-ylamine
- 6-chloro-5-fluoro-2-mercaptobenzimidazole
- 6-Chloro-5-fluorobenzimidazole-2-thiole
- BUTTPARK 81 3-18
- BUTTPARK 81\03-18
- TIMTEC-BB SBB003521
- 2-Benzothiazolamine,5-chloro-6-fluoro-(9CI)
- 6-CHLORO-5-FLUORO-1H-BENZO[D]IMIDAZOLE-2-THIOL
- AKOS022231680
- 101337-92-2
- 2-Benzothiazolamine, 5-chloro-6-fluoro-
- SCHEMBL1638626
-
- Inchi： 1S/C7H4ClFN2S/c8-3-1-5-6(2-4(3)9)12-7(10)11-5/h1-2H,(H2,10,11)
- InChI Key： KIFQKTQYEYQDED-UHFFFAOYSA-N
- SMILES： ClC1C(=CC2=C(C=1)N=C(N)S2)F
Computed Properties
- Exact Mass: 201.97700
- Monoisotopic Mass: 201.9767752g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 12
- Rotatable Bond Count: 0
- Complexity: 183
- 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: 2.8
- Topological Polar Surface Area: 67.2?2
Experimental Properties
- PSA: 67.48000
- LogP: 2.64410
2-Benzothiazolamine,5-chloro-6-fluoro- Related Literature
-
Siquan Zhang,Shengyao Wang,Liping Guo,Hao Chen,Bien Tan,Shangbin Jin J. Mater. Chem. C, 2020,8, 192-200
-
Robert P. Davies,Maria A. Giménez,Laura Patel,Andrew J. P. White Dalton Trans., 2008, 5705-5707
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Juan J. Sánchez,Miguel López-Haro,Juan C. Hernández-Garrido,Ginesa Blanco,Miguel A. Cauqui,José M. Rodríguez-Izquierdo,José A. Pérez-Omil,José J. Calvino,María P. Yeste J. Mater. Chem. A, 2019,7, 8993-9003
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