53531-69-4 Purity
95%
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The molecular formula of 2-Bromo-4'-chloroacetophenone is C8H6BrClO.
The molecular weight of 2-Bromo-4'-chloroacetophenone is 233.49 g/mol.
The IUPAC name of 2-Bromo-4'-chloroacetophenone is 1-(2-bromo-4-chlorophenyl)ethanone.
The InChI key of 2-Bromo-4'-chloroacetophenone is URBATMJMOGHOCE-UHFFFAOYSA-N.
The canonical SMILES of 2-Bromo-4'-chloroacetophenone is CC(=O)C1=C(C=C(C=C1)Cl)Br.
The CAS number of 2-Bromo-4'-chloroacetophenone is 825-40-1.
The EC number of 2-Bromo-4'-chloroacetophenone is 672-231-0.
The XLogP3-AA value of 2-Bromo-4'-chloroacetophenone is 2.9.
The topological polar surface area of 2-Bromo-4'-chloroacetophenone is 17.1Ų.
Yes, 2-Bromo-4'-chloroacetophenone is a canonicalized compound.