2-Bromoacrylic acid

C₃H₃BrO₂CAS 10443-65-9150.96 g/mol

Open in Covalent MOL file

Alkene Carboxylic acid Vinyl halide

Properties

Molecular formula: C₃H₃BrO₂
Molar mass: 150.96 g/mol
Exact mass: 149.9316 Da
Melting point: 72 °C
logP: 0.98Crippen estimate
Polar surface area: 37.3 Å²
H-bond donors / acceptors: 1 / 1
Rotatable bonds: 1

Hazards

Danger

H314 Causes severe skin burns and eye damage100% of notifiers
H317 May cause an allergic skin reaction11.4% of notifiers
H335 May cause respiratory irritation90.9% of notifiers

Aggregated from 44 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P260, P261, P264, P271, P272, P280, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P354+P338, P316, P319, P321, P333+P317, P362+P364, P363, P403+P233, P405, P501

Identifiers

CAS number

10443-65-9

SMILES

C=C(Br)C(=O)O

InChIKey

HMENQNSSJFLQOP-UHFFFAOYSA-N

InChI

InChI=1S/C3H3BrO2/c1-2(4)3(5)6/h1H2,(H,5,6)

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

5 names

2-Propenoic acid, 2-bromo-
Acrylic acid, 2-bromo-
2-Bromo-2-propenoic acid
α-Bromoacrylic acid
NSC 227848

Work with 2-Bromoacrylic acid

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 Isotope patternExact mass and the mass spectrum pattern

Similar compounds

2-(Bromomethyl)acrylic acid72707-66-542 % similar 2-Chloro-2-propenoic acid598-79-842 % similar Methacrylic acid79-41-442 % similar 2-(Trifluoromethyl)acrylic acid381-98-638 % similar Ammonium oxalate1113-38-838 % similar Ethanedioic acid hydrate (1:2)6153-56-638 % similar 2-Acetamidoacrylic acid5429-56-138 % similar Itaconic acid97-65-436 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

2-Bromopropanedial2065-75-0

Elsewhere

PubChem CAS Common Chemistry NIST WebBook