2-bromo-1,3-benzothiazole (CAS 2516-40-7) — formula C7H4BrNS, molecular weight 214.08; category organic chemicals.
2-bromo-1,3-benzothiazole is a carbon-based organic compound with CAS registry number 2516-40-7 and molecular formula C7H4BrNS (molecular weight 214.08), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 2516-40-7
Its molecular formula C7H4BrNS comprises 7 C, 4 H, 1 Br, 1 N, 1 S atoms.
Also known as: 2-bromo-1,3-benzothiazole · 2-溴-1,3-苯并噻唑
Category: organic chemicals
The CAS registry number of 2-bromo-1,3-benzothiazole is 2516-40-7.
Molecular formula C7H4BrNS, molecular weight 214.08.
It is also registered under: 2-bromo-1,3-benzothiazole, 2-溴-1,3-苯并噻唑.
Category: Organic Chemicals.
Public-database records for 2-bromo-1,3-benzothiazole (CAS 2516-40-7), reproduced here for independent cross-checking.
| Reported hazard statements | H301 (93.2%), H319 (93.2%) |
|---|
H301 (93.2%): Toxic if swallowed [Danger Acute toxicity, oral]
H319 (93.2%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
| CAS Registry Number | 2516-40-7 |
|---|---|
| PubChem CID | 612040 |
| 分子式 | C7H4BrNS |
| IUPAC 名称 | 2-bromo-1,3-benzothiazole |
| UNII（FDA） | Z415645026 |
2-Bromobenzothiazole; 2516-40-7; 2-Bromo-1,3-benzothiazole; benzothiazole, 2-bromo-; DTXSID2021498; DTXCID801498; RefChem:465788; 626-296-7; InChI=1/C7H4BrNS/c8-7-9-5-3-1-2-4-6(5)10-7/h1-4; 2-bromobenzo[d]thiazole; MFCD02681887; 2-bromo-benzothiazole; 2-Benzothiazolyl Bromide; Tox21_302813; CS-W004686; NCGC00256377-01
| 分子量 | 214.08 |
|---|---|
| XLogP3 | 3.3 |
| 氢键供体数 | 0 |
| 氢键受体数 | 2 |
| 可旋转键数 | 0 |
| 精确质量 | 212.92478 |
| 单同位素质量 | 212.92478 |
| 拓扑极性表面积 | 41.1 |
| 重原子数 | 10 |
| 形式电荷 | 0 |
2-bromo-1,3-benzothiazole · CAS 2516-40-7 · C7H4BrNS. UNII Z415645026.
Source: PubChem / Wikidata; the batch COA governs where values differ.
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