2-Bromo-1-(2,5-dichlorophenyl)ethanone

C₈H₅BrCl₂OCAS 4571-25-9267.93 g/mol

Open in Covalent MOL file

Alkyl halide Aryl halide Ketone

Properties

Molecular formula: C₈H₅BrCl₂O
Molar mass: 267.93 g/mol
Exact mass: 265.8901 Da
Melting point: 34.5–35 °C
logP: 3.57Crippen estimate
Polar surface area: 17.1 Å²
H-bond donors / acceptors: 0 / 1
Rotatable bonds: 2

Identifiers

CAS number

4571-25-9

SMILES

O=C(CBr)c1cc(Cl)ccc1Cl

InChIKey

JGILXRDUULAMPY-UHFFFAOYSA-N

InChI

InChI=1S/C8H5BrCl2O/c9-4-8(12)6-3-5(10)1-2-7(6)11/h1-3H,4H2

Weigh it out

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

Names and synonyms

6 names

Ethanone, 2-bromo-1-(2,5-dichlorophenyl)-
Acetophenone, 2-bromo-2′,5′-dichloro-
2-Bromo-2′,5′-dichloroacetophenone
2,5-Dichlorophenacyl bromide
α-Bromo-2′,5′-dichloroacetophenone
2-Bromo-1-(2,5-dichlorophenyl)ethan-1-one

Work with 2-Bromo-1-(2,5-dichlorophenyl)ethanone

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-Bromo-1-(2-chlorophenyl)ethanone5000-66-867 % similar 2′-Bromo-4-chloroacetophenone536-38-956 % similar 2-Bromo-1-(3-chlorophenyl)ethanone41011-01-256 % similar 2,5-Dichlorobenzoyl chloride2905-61-554 % similar 2,5-Dichlorobenzoic acid50-79-354 % similar 1-(2,5-Dichlorophenyl)ethanone2476-37-153 % similar 2,2′,4′-Trichloroacetophenone4252-78-250 % similar Ethyl 2,5-dichlorobenzoate35112-27-749 % similar

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

Same formula

2,4-Dichlorophenacyl bromide2631-72-3

Elsewhere

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