4′-Bromo-3-chloropropiophenone

4′-Bromo-3-chloropropiophenone, a halogenated propiophenone derivative, is also known as 1-(4-bromophenyl)-3-chloro-1-propanone. Its molecular geometry has been studied based on density functional theory (DFT) calculations, FTIR and FT Raman spectra.

Catalog Number CBB1121652
Molecular Formula BrC6H4COCH2CH2Cl
CAS# 31736-73-9
Purity >95%
Inchi 1S/C9H8BrClO/c10-8-3-1-7(2-4-8)9(12)5-6-11/h1-4H,5-6H2
Inchi Key SYWQQEVHZPPLNQ-UHFFFAOYSA-N
SMILES ClCCC(=O)c1ccc(Br)cc1
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