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Specification
The molecular formula of the compound is C9H9BrO3.
The synonyms for the compound include 5-Bromo-2-methoxyphenylacetic acid, 7017-48-3, and (5-bromo-2-methoxyphenyl)acetic acid.
The molecular weight of the compound is 245.07 g/mol.
The IUPAC name of the compound is 2-(5-bromo-2-methoxyphenyl)acetic acid.
The canonical SMILES notation for the compound is COC1=C(C=C(C=C1)Br)CC(=O)O.
The compound has 1 hydrogen bond donor count.
The topological polar surface area of the compound is 46.5Ų.
No, the compound does not have any defined atom stereocenters.
The compound has 1 covalently-bonded unit count.
Yes, the compound is canonicalized.