5-Chloro-2-mercaptobenzothiazole (CAS 5331-91-9) — formula C7H4ClNS2, molecular weight 201.7; category organic chemicals.
| CAS Number | 5331-91-9 |
|---|---|
| Molecular Formula | C7H4ClNS2 |
| Molecular Weight | 201.7 |
| LogP | 3 |
| Category | Organic Chemicals |
5-Chloro-2-mercaptobenzothiazole is a carbon-based organic compound with CAS registry number 5331-91-9 and molecular formula C7H4ClNS2 (molecular weight 201.7), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 5331-91-9
Its molecular formula C7H4ClNS2 comprises 7 C, 4 H, 1 Cl, 1 N, 2 S atoms.
Also known as: 5-Chloro-2-mercaptobenzothiazole · 5-氯-2-巯基苯并噻唑
Category: organic chemicals
The CAS registry number of 5-Chloro-2-mercaptobenzothiazole is 5331-91-9.
Molecular formula C7H4ClNS2, molecular weight 201.7.
It is also registered under: 5-Chloro-2-mercaptobenzothiazole, 5-氯-2-巯基苯并噻唑.
Category: Organic Chemicals.
Independent reference data for 5-Chloro-2-mercaptobenzothiazole (CAS 5331-91-9), compiled from public chemistry databases.
| CAS 号 | 5331-91-9 |
|---|---|
| PubChem CID | 2723842 |
| 分子式 | C7H4ClNS2 |
| IUPAC 名称 | 5-chloro-3H-1,3-benzothiazole-2-thione |
| UNII（FDA） | R9099U429R |
| Molecular Weight | 201.7 |
|---|---|
| XLogP3 | 3 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 0 |
| Exact Mass | 200.9473692 |
| Monoisotopic Mass | 200.9473692 |
| Topological Polar Surface Area | 69.4 |
| Heavy Atom Count | 11 |
5-Chloro-2-mercaptobenzothiazole; 5331-91-9; SH-Benzothiazole; 2(3H)-Benzothiazolethione, 5-chloro-; 5-Chloro-2-benzothiazolethiol; 2-BENZOTHIAZOLETHIOL, 5-CHLORO-; NSC-3934; R9099U429R; RefChem:534567; 226-235-0; 5-Chlorobenzo[d]thiazole-2(3H)-thione; 5-chloro-1,3-benzothiazole-2-thiol; 5-chloro-3H-1,3-benzothiazole-2-thione; 5-Chlorobenzo[d]thiazole-2-thiol; Benzothiazole, 5-chloro-2-mercapto-; CMBT
| 已通报的危害声明 | H315 (100%), H319 (100%), H335 (83.3%) |
|---|
5-氯-2-巯基苯并噻唑 · CAS 5331-91-9 · C7H4ClNS2. UNII R9099U429R.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 5-氯-2-巯基苯并噻唑