4-Bromophenylacetyl chloride

C₈H₆BrClOCAS 37859-24-8233.49 g/mol

Open in Covalent MOL file

Acyl halide Aryl halide

Properties

Molecular formula: C₈H₆BrClO
Molar mass: 233.49 g/mol
Exact mass: 231.9291 Da
logP: 2.76Crippen estimate
Polar surface area: 17.1 Å²
H-bond donors / acceptors: 0 / 1
Rotatable bonds: 2

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

37859-24-8

SMILES

C1=CC(=CC=C1CC(=O)Cl)Br

InChIKey

VQVBNWUUKLBHGI-UHFFFAOYSA-N

InChI

InChI=1S/C8H6BrClO/c9-7-3-1-6(2-4-7)5-8(10)11/h1-4H,5H2

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Names and synonyms

1 names

Benzeneacetyl chloride, 4-bromo-

Work with 4-Bromophenylacetyl 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 Isotope patternExact mass and the mass spectrum pattern

Similar compounds

4-Chlorobenzeneacetyl chloride25026-34-062 % similar Phenylacetyl chloride103-80-061 % similar 2-(4-Fluorophenyl)acetyl chloride459-04-160 % similar 1-(4-Bromophenyl)propan-2-one6186-22-757 % similar 4-Bromophenylacetic acid1878-68-855 % similar 4-Methoxybenzeneacetyl chloride4693-91-855 % similar 2-Naphthaleneacetyl chloride37859-25-950 % similar Methyl (4-bromophenyl)acetate41841-16-150 % similar

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

Same formula

2-Bromo-1-(3-chlorophenyl)ethanone41011-01-2 1-(4-Bromophenyl)-2-chloroethanone4209-02-3 2-Bromo-1-(2-chlorophenyl)ethanone5000-66-8 2′-Bromo-4-chloroacetophenone536-38-9 1-(2-Bromo-4-chlorophenyl)ethanone825-40-1

Elsewhere

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