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The molecular formula is C8H8BFO4.
It was created on November 30, 2012.
The IUPAC name is 3-borono-5-fluoro-4-methylbenzoic acid.
The InChI is InChI=1S/C8H8BFO4/c1-4-6(9(13)14)2-5(8(11)12)3-7(4)10/h2-3,13-14H,1H3,(H,11,12).
The InChIKey is KLHYMSYPRCYQQZ-UHFFFAOYSA-N.
The canonical SMILES is B(C1=CC(=CC(=C1C)F)C(=O)O)(O)O.
The CAS identifier is 917223-87-1.
The molecular weight is 197.96 g/mol.
It has 3 hydrogen bond donor counts.
It has 5 hydrogen bond acceptor counts.
91722-21-3
91722-22-4
91722-29-1
91722-47-3
91722-59-7
91722-67-7
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