CAS
952514-79-3 Purity
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952514-79-3 Purity
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The molecular formula is C13H12BFO3.
The compound was created on January 26, 2010.
The molecular weight is 246.04 g/mol.
The IUPAC name is (4-fluoro-3-phenylmethoxyphenyl)boronic acid.
The canonical SMILES is B(C1=CC(=C(C=C1)F)OCC2=CC=CC=C2)(O)O.
There are 2 hydrogen bond donor counts.
There are 4 rotatable bond counts.
The exact mass is 246.0863526 g/mol.
Yes, the compound is canonicalized.
There are 4 hydrogen bond acceptor counts.