Bromoacetyl chloride

C2H2BrClOCAS 22118-09-8157.39 g/mol

Open in Covalent MOL file
OClBr
Acyl halideAlkyl halide

Properties

Molecular formula
C2H2BrClO
Molar mass
157.39 g/mol
Exact mass
155.8978 Da
Density
1.914 g/mL (at 20 °C)
Boiling point
115–117 °C
logP
1.15Crippen estimate
Polar surface area
17.1 Ų
H-bond donors / acceptors
0 / 1
Rotatable bonds
1

Hazards

Danger
Corrosive (GHS05)Irritant (GHS07)

Aggregated from 43 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

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

Identifiers

CAS number
22118-09-8
SMILES
O=C(Cl)CBr
InChIKey
SYZRZLUNWVNNNV-UHFFFAOYSA-N
InChI
InChI=1S/C2H2BrClO/c3-1-2(4)5/h1H2

Weigh it out

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Names and synonyms

5 names
  • Acetyl chloride, 2-bromo-
  • Acetyl chloride, bromo-
  • 2-Bromoacetyl chloride
  • NSC 97376
  • 2-Bromo-1-chloro-ethanal

Work with Bromoacetyl 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

3-Bromopropanoyl chloride15486-96-152 % similar Malonyl chloride1663-67-850 % similar Succinyl chloride543-20-450 % similar 4-Bromobutanoyl chloride927-58-248 % similar 5-Bromovaleryl chloride4509-90-446 % similar Adipoyl chloride111-50-245 % similar Glutaryl chloride2873-74-745 % similar Chloroacetyl chloride79-04-945 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

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