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The molecular formula is C8H7BrO3.
The molecular weight is 231.04 g/mol.
The IUPAC name is 3-bromo-5-methoxybenzoic acid.
The InChI is InChI=1S/C8H7BrO3/c1-12-7-3-5(8(10)11)2-6(9)4-7/h2-4H,1H3,(H,10,11).
The InChIKey is DMXJBCHYVUGXEH-UHFFFAOYSA-N.
The canonical SMILES is COC1=CC(=CC(=C1)C(=O)O)Br.
The CAS number is 157893-14-6.
The European Community (EC) number is 630-199-5.
The XLogP3 value is 2.9.
Yes, it is a canonicalized compound.
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