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The molecular formula is C14H12BF3O3.
The molecular weight is 296.05 g/mol.
The IUPAC name is [2-phenylmethoxy-5-(trifluoromethyl)phenyl]boronic acid.
The InChI is InChI=1S/C14H12BF3O3/c16-14(17,18)11-6-7-13(12(8-11)15(19)20)21-9-10-4-2-1-3-5-10/h1-8,19-20H,9H2.
The InChIKey is NWZHBEJEZSNEIF-UHFFFAOYSA-N.
The canonical SMILES is B(C1=C(C=CC(=C1)C(F)(F)F)OCC2=CC=CC=C2)(O)O.
The CAS number is 612833-41-7.
The hydrogen bond donor count is 2.
The hydrogen bond acceptor count is 6.
Yes, it is canonicalized according to PubChem.
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