2-Bromohexanoic acid (CAS 616-05-7) — formula C6H11BrO2, molecular weight 195.05; category organic chemicals.
Documented applications: General Manufacturing Information: Hexanoic acid, 2-bromo-: ACTIVE.
2-Bromohexanoic acid is a carbon-based organic compound with CAS registry number 616-05-7 and molecular formula C6H11BrO2 (molecular weight 195.05), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 616-05-7
Its molecular formula C6H11BrO2 comprises 6 C, 11 H, 1 Br, 2 O atoms.
Also known as: 2-Bromohexanoic acid · 2-溴己酸
Category: organic chemicals
The CAS registry number of 2-Bromohexanoic acid is 616-05-7.
Molecular formula C6H11BrO2, molecular weight 195.05.
It is also registered under: 2-Bromohexanoic acid, 2-溴己酸.
Recorded applications: General Manufacturing Information: Hexanoic acid, 2-bromo-: ACTIVE.
Category: Organic Chemicals.
Public-database records for 2-Bromohexanoic acid (CAS 616-05-7), reproduced here for independent cross-checking.
| Reported hazard statements | H302, H312, H332 (32.6%), H314 (98.8%), H318 (91.9%), H371 (12.8%) |
|---|
H302+H312+H332 (32.6%): Harmful if swallowed, in contact with skin or if inhaled [Warning Acute toxicity, oral; acute toxicity, dermal; acute toxicity, inhalation]
H302 (93%): Harmful if swallowed [Warning Acute toxicity, oral]
| CAS Registry Number | 616-05-7 |
|---|---|
| PubChem CID | 12013 |
| 分子式 | C6H11BrO2 |
| IUPAC 名称 | 2-bromohexanoic acid |
| UNII（FDA） | 99GKX2FXIB |
2-BROMOHEXANOIC ACID; 616-05-7; 2-Bromocaproic acid; Hexanoic acid, 2-bromo-; alpha-Bromohexanoic acid; alpha-Bromo-n-caproic acid; alpha-Bromocaproic acid; .alpha.-Bromo-n-caproic acid; 99GKX2FXIB; .alpha.-Bromohexanoic acid; EINECS 210-461-1; NSC 73987; AI3-11171; hexanoic acid, 2-bromo; NSC-73987; DTXSID50883244
| 分子量 | 195.05 |
|---|---|
| XLogP3 | 2.4 |
| 氢键供体数 | 1 |
| 氢键受体数 | 2 |
| 可旋转键数 | 4 |
| 精确质量 | 193.99424 |
| 单同位素质量 | 193.99424 |
| 拓扑极性表面积 | 37.3 |
| 重原子数 | 9 |
| 形式电荷 | 0 |
2-Bromohexanoic acid · CAS 616-05-7 · C6H11BrO2. UNII 99GKX2FXIB.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd. · Reply within one business day.