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Specification
The molecular formula is C16H14O4.
The molecular weight is 270.28 g/mol.
The IUPAC name is 2-(4-acetylphenoxy)-2-phenylacetic acid.
The InChI is InChI=1S/C16H14O4/c1-11(17)12-7-9-14(10-8-12)20-15(16(18)19)13-5-3-2-4-6-13/h2-10,15H,1H3,(H,18,19).
The InChIKey is BMEHMYIRXJTQGE-UHFFFAOYSA-N.
The canonical SMILES is CC(=O)C1=CC=C(C=C1)OC(C2=CC=CC=C2)C(=O)O.
The CAS number is 885949-44-0.
The XLogP3-AA value is 2.9.
The compound has 1 hydrogen bond donor count.
The compound has 4 hydrogen bond acceptor counts.