2-Bromoallylamine

C₃H₆BrNCAS 6943-51-7135.99 g/mol

Open in Covalent MOL file

Alkene Primary amine Vinyl halide

Properties

Molecular formula: C₃H₆BrN
Molar mass: 135.99 g/mol
Exact mass: 134.9684 Da
logP: 0.85Crippen estimate
Polar surface area: 26.0 Å²
H-bond donors / acceptors: 1 / 1
Rotatable bonds: 1

Hazards

Danger

H226 Flammable liquid and vapor100% of notifiers
H314 Causes severe skin burns and eye damage100% of notifiers
H335 May cause respiratory irritation100% of notifiers

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

Precautionary statements

P210, P233, P240, P241, P242, P243, P260, P261, P264, P271, P280, P301+P330+P331, P302+P361+P354, P303+P361+P353, P304+P340, P305+P354+P338, P316, P319, P321, P363, P370+P378, P403+P233, P403+P235, P405, P501

Identifiers

CAS number

6943-51-7

SMILES

C=C(CN)Br

InChIKey

XFSISDMYBCYBKG-UHFFFAOYSA-N

InChI

InChI=1S/C3H6BrN/c1-3(4)2-5/h1-2,5H2

Weigh it out

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

Names and synonyms

4 names

2-Bromoprop-2-en-1-amine
2-Bromo-2-propen-1-amine
2-Propen-1-amine, 2-bromo-
2-Bromo-allylamine

Reactions

2-BROMOALLYLAMINE (Allylamine, 2-bromo-)product

Work with 2-Bromoallylamine

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

2,3-Dibromopropene513-31-553 % similar 2-Bromo-1-butene23074-36-443 % similar 3-Cyclohexyl-2-bromopropene53608-85-835 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

PubChem CAS Common Chemistry NIST WebBook