Boronic acid, B-[3-bromo-5-[[(4-fluorophenyl)amino]carbonyl]phenyl]-

CAS Registry Number®

2121513-21-9
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CAS Name

Boronic acid, B-[3-bromo-5-[[(4-fluorophenyl)amino]carbonyl]phenyl]-

Molecular Formula

C13H10BBrFNO3

Molecular Mass

337.94

Cite this Page

Boronic acid, B-[3-bromo-5-[[(4-fluorophenyl)amino]carbonyl]phenyl]-.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=2121513-21-9 (retrieved 2024-08-21) (CAS RN: 2121513-21-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C13H10BBrFNO3/c15-10-6-8(5-9(7-10)14(19)20)13(18)17-12-3-1-11(16)2-4-12/h1-7,19-20H,(H,17,18)

InChIKey

InChIKey=SKAGFNBENCSPHU-UHFFFAOYSA-N

SMILES

C(NC1=CC=C(F)C=C1)(=O)C2=CC(B(O)O)=CC(Br)=C2

Canonical SMILES

O=C(NC1=CC=C(F)C=C1)C=2C=C(Br)C=C(C2)B(O)O

Other Names for this Substance

  • Boronic acid, B-[3-bromo-5-[[(4-fluorophenyl)amino]carbonyl]phenyl]-