CAS
150935-62-9 Purity
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150935-62-9 Purity
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The molecular formula is C9H9BrO2.
The molecular weight is 229.07 g/mol.
The IUPAC name is 3-(2-bromophenyl)propanoic acid.
The InChI is InChI=1S/C9H9BrO2/c10-8-4-2-1-3-7(8)5-6-9(11)12/h1-4H,5-6H2,(H,11,12).
The InChIKey is AOACQJFIGWNQBC-UHFFFAOYSA-N.
The canonical SMILES is C1=CC=C(C(=C1)CCC(=O)O)Br.
The CAS number is 15115-58-9.
The European Community (EC) number is 629-087-9.
The DSSTox Substance ID is DTXSID30311434.
The XLogP3-AA value is 2.4.