Ethyl 2-bromo-3-methylbutyrate (CAS 609-12-1) — formula C7H13BrO2, molecular weight 209.08; category organic chemicals.
Documented applications: General Manufacturing Information: Butanoic acid, 2-bromo-3-methyl-, ethyl ester: INACTIVE.
Ethyl 2-bromo-3-methylbutyrate is a carbon-based organic compound with CAS registry number 609-12-1 and molecular formula C7H13BrO2 (molecular weight 209.08), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 609-12-1
Its molecular formula C7H13BrO2 comprises 7 C, 13 H, 1 Br, 2 O atoms.
Also known as: Ethyl 2-bromo-3-methylbutyrate · Ethyl 2-bromoisovalerate
Category: organic chemicals
The CAS registry number of Ethyl 2-bromo-3-methylbutyrate is 609-12-1.
Molecular formula C7H13BrO2, molecular weight 209.08.
It is also registered under: Ethyl 2-bromo-3-methylbutyrate, Ethyl 2-bromoisovalerate.
Recorded applications: General Manufacturing Information: Butanoic acid, 2-bromo-3-methyl-, ethyl ester: INACTIVE.
Category: Organic Chemicals.
Public-database records for Ethyl 2-bromo-3-methylbutyrate (CAS 609-12-1), reproduced here for independent cross-checking.
| Reported hazard statements | H302 (85.7%), H314 (93.9%) |
|---|
H302 (85.7%): Harmful if swallowed [Warning Acute toxicity, oral]
H314 (93.9%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]
| CAS Registry Number | 609-12-1 |
|---|---|
| PubChem CID | 79068 |
| 分子式 | C7H13BrO2 |
| IUPAC 名称 | ethyl 2-bromo-3-methylbutanoate |
| UNII（FDA） | 4J9877130M |
Ethyl 2-bromoisovalerate; 609-12-1; Ethyl 2-bromo-3-methylbutanoate; Ethyl 2-bromo-3-methylbutyrate; Butanoic acid, 2-bromo-3-methyl-, ethyl ester; Ethyl .alpha.-bromoisovalerate; Ethyl alpha-bromoisovalerate; alpha-Bromoisovaleric acid ethyl ester; Butyric acid, 2-bromo-3-methyl-, ethyl ester; 2-BROMO-3-METHYLBUTANOIC ACID ETHYL ESTER; UNII-4J9877130M; NSC 8866; NSC-8866; EINECS 210-178-3; .alpha.-Bromoisovaleric acid ethyl ester; AI3-52374
| 分子量 | 209.08 |
|---|---|
| XLogP3 | 2.6 |
| 氢键供体数 | 0 |
| 氢键受体数 | 2 |
| 可旋转键数 | 4 |
| 精确质量 | 208.00989 |
| 单同位素质量 | 208.00989 |
| 拓扑极性表面积 | 26.3 |
| 重原子数 | 10 |
| 形式电荷 | 0 |
Ethyl 2-bromo-3-methylbutyrate · CAS 609-12-1 · C7H13BrO2. UNII 4J9877130M.
Source: PubChem / Wikidata; the batch COA governs where values differ.
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