chempirical

2-Bromopropanoyl chloride

C3H4BrClOCAS 7148-74-5171.42 g/mol

Open in Covalent MOL file
BrOCl
Acyl halideAlkyl halide

Properties

Molecular formula
C3H4BrClO
Molar mass
171.42 g/mol
Exact mass
169.9134 Da
Boiling point
132 °C
logP
1.54Crippen estimate
Polar surface area
17.1 Ų
H-bond donors / acceptors
0 / 1
Rotatable bonds
1

Identifiers

CAS number
7148-74-5
SMILES
CC(Br)C(=O)Cl
InChIKey
OZGMODDEIHYPRY-UHFFFAOYSA-N
InChI
InChI=1S/C3H4BrClO/c1-2(4)3(5)6/h2H,1H3

Weigh it out

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

Names and synonyms

9 names
  • Propanoyl chloride, 2-bromo-
  • Propionyl chloride, 2-bromo-
  • α-Bromopropionyl chloride
  • 2-Bromopropionyl chloride
  • α-Bromopropionic acid chloride
  • α-Bromopropanoyl chloride
  • 2-Bromopropionic acid chloride
  • (±)-2-Bromopropionyl chloride
  • NSC 64455

Work with 2-Bromopropanoyl chloride

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

Isobutyryl chloride79-30-150 % similar 2-Bromopropionyl bromide563-76-846 % similar 2-Chloropropanoyl chloride7623-09-846 % similar 3-Bromo-2-butanone814-75-546 % similar (R)-(+)-2-Bromopropionic acid10009-70-844 % similar (2S)-2-Bromopropanoic acid32644-15-844 % similar 2-Bromopropionic acid598-72-144 % similar 2,3-Dibromopropanoyl chloride18791-02-141 % similar

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

Same formula

3-Bromopropanoyl chloride15486-96-1

Elsewhere

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