Cas no 939803-85-7 (5,7-Dichloro-1,3-benzothiazole)
939803-85-7 structure
Product Name:5,7-Dichloro-1,3-benzothiazole
CAS No:939803-85-7
MF:C7H3Cl2NS
MW:204.076418161392
CID:854964
PubChem ID:21424359
Update Time:2025-04-19
5,7-Dichloro-1,3-benzothiazole Chemical and Physical Properties
Names and Identifiers
-
- 5,7-dichloro-1,3-benzothiazole
- 5,7-Dichlorobenzothiazole
- 939803-85-7
- SCHEMBL11714933
- DTXSID90613628
- 5,7-Dichlorobenzo[d]thiazole
- DB-242201
- 5,7-Dichloro-1,3-benzothiazole
-
- Inchi： 1S/C7H3Cl2NS/c8-4-1-5(9)7-6(2-4)10-3-11-7/h1-3H
- InChI Key： INEOEHMEKFEZHY-UHFFFAOYSA-N
- SMILES： ClC1=CC(=CC2=C1SC=N2)Cl
Computed Properties
- Exact Mass: 202.9363257g/mol
- Monoisotopic Mass: 202.9363257g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 11
- Rotatable Bond Count: 0
- Complexity: 155
- 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: 3.6
- Topological Polar Surface Area: 41.1?2
5,7-Dichloro-1,3-benzothiazole Related Literature
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Ni-Na Sun,Fengli Qu,Xiaobing Zhang,Shufang Zhang,Jinmao You Analyst, 2015,140, 1827-1831
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3. An integrated microfluidic 3D tumor system for parallel and high-throughput chemotherapy evaluation?Dan Liu,Rui Hu,Zhongchao Huang,Meilin Sun,Kai Han Analyst, 2020,145, 6447-6455
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James D. Kirkham,Patrick M. Delaney,George J. Ellames,Eleanor C. Row,Joseph P. A. Harrity Chem. Commun., 2010,46, 5154-5156
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Xin Fu,Qing-rong Liang,Rong-guang Luo,Yan-shu Li,Xiao-ping Xiao,Lu-lu Yu,Wen-zhe Shan,Guang-qin Fan J. Mater. Chem. B, 2019,7, 3088-3099
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