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The molecular formula of the compound is C10H9BrO3.
The molecular weight of the compound is 257.08 g/mol.
The IUPAC name of the compound is 4-(4-bromophenyl)-4-oxobutanoic acid.
The InChI of the compound is InChI=1S/C10H9BrO3/c11-8-3-1-7(2-4-8)9(12)5-6-10(13)14/h1-4H,5-6H2,(H,13,14).
The InChIKey of the compound is ZODFRCZNTXLDDW-UHFFFAOYSA-N.
The canonical SMILES of the compound is C1=CC(=CC=C1C(=O)CCC(=O)O)Br.
The CAS number of the compound is 6340-79-0.
The XLogP3 value of the compound is 2.1.
The compound has 1 hydrogen bond donor count.
The topological polar surface area of the compound is 54.4Ų.
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