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

CAS Registry Number®

117291-16-4

CAS Name

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

Molecular Formula

C11H9F4NO3

Molecular Mass

279.19

Cite this Page

4-Fluoro-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=117291-16-4 (retrieved 2024-11-24) (CAS RN: 117291-16-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C11H9F4NO3/c12-7-3-1-6(2-4-7)8(5-9(17)18)16-10(19)11(13,14)15/h1-4,8H,5H2,(H,16,19)(H,17,18)

InChIKey

InChIKey=NPQRPZRZZQVZIJ-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

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

Other Names for this Substance

  • Benzenepropanoic acid, 4-fluoro-β-[(2,2,2-trifluoroacetyl)amino]-
  • Benzenepropanoic acid, 4-fluoro-β-[(trifluoroacetyl)amino]-
  • 4-Fluoro-β-[(2,2,2-trifluoroacetyl)amino]benzenepropanoic acid

CAS INSIGHTSTM
Hourglass and a clock