Methyl 5-bromovalerate (CAS 5454-83-1) — formula C6H11BrO2, molecular weight 195.05; category organic chemicals.
| CAS Number | 5454-83-1 |
|---|---|
| Molecular Formula | C6H11BrO2 |
| Molecular Weight | 195.05 |
| LogP | 1.9 |
| Applications | General Manufacturing Information: Pentanoic acid, 5-bromo-, methyl ester: ACTIVE |
| Category | Organic Chemicals |
Documented applications: General Manufacturing Information: Pentanoic acid, 5-bromo-, methyl ester: ACTIVE.
Methyl 5-bromovalerate is a carbon-based organic compound with CAS registry number 5454-83-1 and molecular formula C6H11BrO2 (molecular weight 195.05), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 5454-83-1
Its molecular formula C6H11BrO2 comprises 6 C, 11 H, 1 Br, 2 O atoms.
Also known as: Methyl 5-bromovalerate · 5-溴戊酸甲酯
Category: organic chemicals
The CAS registry number of Methyl 5-bromovalerate is 5454-83-1.
Molecular formula C6H11BrO2, molecular weight 195.05.
It is also registered under: Methyl 5-bromovalerate, 5-溴戊酸甲酯.
Recorded applications: General Manufacturing Information: Pentanoic acid, 5-bromo-, methyl ester: ACTIVE.
Category: Organic Chemicals.
Independent reference data for Methyl 5-bromovalerate (CAS 5454-83-1), compiled from public chemistry databases.
| CAS Registry Number | 5454-83-1 |
|---|---|
| PubChem CID | 79557 |
| Molecular formula | C6H11BrO2 |
| IUPAC name | methyl 5-bromopentanoate |
| UNII (FDA) | NS00033124 |
| Molecular Weight | 195.05 |
|---|---|
| XLogP3 | 1.9 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 5 |
| Exact Mass | 193.99424 |
| Monoisotopic Mass | 193.99424 |
| Topological Polar Surface Area | 26.3 |
| Heavy Atom Count | 9 |
Methyl 5-bromovalerate; Methyl 5-bromopentanoate; Pentanoic acid, 5-bromo-, methyl ester; EINECS 226-709-7; NSC 23228; Br(CH2)4C(O)OCH3; DTXSID4063907; RAVVJKCSZXAIQP-UHFFFAOYSA-; RefChem:157680; DTXCID3041744; 226-709-7; InChI=1/C6H11BrO2/c1-9-6(8)4-2-3-5-7/h2-5H2,1H3; RAVVJKCSZXAIQP-UHFFFAOYSA-N; 5454-83-1; 5-Bromovaleric acid methyl ester; MFCD00000265
| GHS notification summary | 33.3% (1 / 3) |
|---|
| GHS notification summary | 33.3% (1 / 3) |
|---|---|
| Reported hazard statements | H315 (66.7%), H319 (66.7%), H335 (33.3%) |
This chemical does not meet GHS hazard criteria for 33.3% (1 of 3) of reports.
H315 (66.7%): Causes skin irritation [Warning Skin corrosion/irritation]
Methyl 5-bromovalerate · CAS 5454-83-1 · C6H11BrO2. UNII NS00033124.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 5-溴戊酸甲酯