CAS
133057-83-7 Purity
98%
133057-83-7 Purity
98%
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The molecular formula is C7H7BFNO3.
The molecular weight is 182.95 g/mol.
The IUPAC name is (3-carbamoyl-2-fluorophenyl)boronic acid.
The InChI is InChI=1S/C7H7BFNO3/c9-6-4(7(10)11)2-1-3-5(6)8(12)13/h1-3,12-13H,(H2,10,11).
The InChIKey is RBTYOTCFMGEGAV-UHFFFAOYSA-N.
The canonical SMILES is B(C1=C(C(=CC=C1)C(=O)N)F)(O)O.
The CAS number is 1451392-76-9.
The EC number is 828-590-2.
It has 3 hydrogen bond donor counts.
It has 4 hydrogen bond acceptor counts.