2-Bromo-β-[(2,2,2-trifluoroacetyl)amino]benzenepropanoic acid

CAS Registry Number®

117291-11-9
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CAS Name

2-Bromo-β-[(2,2,2-trifluoroacetyl)amino]benzenepropanoic acid

Molecular Formula

C11H9BrF3NO3

Molecular Mass

340.09

Cite this Page

2-Bromo-β-[(2,2,2-trifluoroacetyl)amino]benzenepropanoic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=117291-11-9 (retrieved 2024-09-08) (CAS RN: 117291-11-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C11H9BrF3NO3/c12-7-4-2-1-3-6(7)8(5-9(17)18)16-10(19)11(13,14)15/h1-4,8H,5H2,(H,16,19)(H,17,18)

InChIKey

InChIKey=GUYNVUOQFJZCAW-UHFFFAOYSA-N

SMILES

C(NC(C(F)(F)F)=O)(CC(O)=O)C1=C(Br)C=CC=C1

Canonical SMILES

O=C(O)CC(NC(=O)C(F)(F)F)C=1C=CC=CC1Br

Other Names for this Substance

  • Benzenepropanoic acid, 2-bromo-β-[(2,2,2-trifluoroacetyl)amino]-
  • Benzenepropanoic acid, 2-bromo-β-[(trifluoroacetyl)amino]-
  • 2-Bromo-β-[(2,2,2-trifluoroacetyl)amino]benzenepropanoic acid