2-Bromo-1-(4-chlorophenyl)-1-propanone

C₉H₈BrClOCAS 877-37-2247.52 g/mol

Open in Covalent MOL file

Alkyl halide Aryl halide Ketone

Properties

Molecular formula: C₉H₈BrClO
Molar mass: 247.52 g/mol
Exact mass: 245.9447 Da
Melting point: 77–79 °C
logP: 3.31Crippen estimate
Polar surface area: 17.1 Å²
H-bond donors / acceptors: 0 / 1
Rotatable bonds: 2

Identifiers

CAS number

877-37-2

SMILES

CC(Br)C(=O)c1ccc(Cl)cc1

InChIKey

SAKMPXRILWVZEG-UHFFFAOYSA-N

InChI

InChI=1S/C9H8BrClO/c1-6(10)9(12)7-2-4-8(11)5-3-7/h2-6H,1H3

Weigh it out

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

Names and synonyms

5 names

1-Propanone, 2-bromo-1-(4-chlorophenyl)-
Propiophenone, 2-bromo-4′-chloro-
α-Bromo-4′-chloropropiophenone
α-Bromo-p-chloropropiophenone
2-Bromo-4′-chloropropiophenone

Work with 2-Bromo-1-(4-chlorophenyl)-1-propanone

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

α-Bromopropiophenone2114-00-363 % similar (4-Chlorophenyl)cyclopropylmethanone6640-25-156 % similar 2-Bromo-1-(3-methylphenyl)-1-propanone1451-83-853 % similar 2-Bromo-1-[4-(phenylmethoxy)phenyl]-1-propanone35081-45-949 % similar P-Chloroacetophenone99-91-247 % similar 4,4′-Dichlorobenzil3457-46-347 % similar 4,4'-Dichlorobenzophenone90-98-247 % similar 4-Chlorobenzoyl chloride122-01-044 % similar

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

Same formula

1-(4-Bromophenyl)-3-chloro-1-propanone31736-73-9 2-Bromo-1-(3-chlorophenyl)-1-propanone34911-51-8

Elsewhere

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