Methyl 2-bromoacetate
Properties
- Molecular formula
- C3H5BrO2
- Molar mass
- 152.98 g/mol
- Exact mass
- 151.9473 Da
- Melting point
- 205–207 °C
- Boiling point
- 132 °C
- logP
- 0.55Crippen estimate
- Polar surface area
- 26.3 Ų
- H-bond donors / acceptors
- 0 / 2
- Rotatable bonds
- 1
Hazards
No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library
Identifiers
CAS number
96-32-2SMILES
COC(=O)CBrInChIKey
YDCHPLOFQATIDS-UHFFFAOYSA-NInChI
InChI=1S/C3H5BrO2/c1-6-3(5)2-4/h2H2,1H3Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
10 names
- Acetic acid, 2-bromo-, methyl ester
- Acetic acid, bromo-, methyl ester
- Methyl bromoacetate
- Bromoacetic acid methyl ester
- Methyl α-bromoacetate
- Methyl monobromoacetate
- Carbomethoxymethyl bromide
- 2-Bromoacetic acid methyl ester
- NSC 2642
- Methyl 2-bromoethanoate
Work with Methyl 2-bromoacetate
Predict the NMR spectrum1H and 13C shifts with multiplicities
Make a solutionWhat to weigh for any molarity and volume
Check drug-likenessLipinski, Veber and lead-likeness
Boiling point under vacuumAt any pressure, from its normal boiling point
Isotope patternExact mass and the mass spectrum pattern
Similar compounds
Methyl 3-bromopropanoate3395-91-358 % similar
Dimethyl succinate106-65-057 % similar
Dimethyl malonate108-59-857 % similar
Bromoacetic anhydride13094-51-457 % similar
Dimethyl glutarate1119-40-055 % similar
Methyl 4-bromobutyrate4897-84-154 % similar
1,1′-(1,2-Ethanediyl) bis(2-bromoacetate)3785-34-052 % similar
Methyl propionate554-12-152 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds