CAS
136264-28-3 Purity
96%
136264-28-3 Purity
96%
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The molecular formula is C9H9BrO3.
The molecular weight is 245.07 g/mol.
The IUPAC name is 2-(5-bromo-2-methoxyphenyl)acetic acid.
The InChI is InChI=1S/C9H9BrO3/c1-13-8-3-2-7(10)4-6(8)5-9(11)12/h2-4H,5H2,1H3,(H,11,12).
The InChIKey is BBHBUJQFVCMESB-UHFFFAOYSA-N.
The canonical SMILES is COC1=C(C=C(C=C1)Br)CC(=O)O.
The CAS number is 7017-48-3.
The EC number is 675-665-9.
The molecular weight is 245.07 g/mol.
Yes, it is canonicalized according to PubChem.