Benzoic acid, 4-amino-3-(trifluoromethyl)-, methyl ester

CAS Registry Number®

167760-75-0

CAS Name

Benzoic acid, 4-amino-3-(trifluoromethyl)-, methyl ester

Molecular Formula

C9H8F3NO2

Molecular Mass

219.16

Cite this Page

Benzoic acid, 4-amino-3-(trifluoromethyl)-, methyl ester.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=167760-75-0 (retrieved 2024-11-22) (CAS RN: 167760-75-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    112-114 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C9H8F3NO2/c1-15-8(14)5-2-3-7(13)6(4-5)9(10,11)12/h2-4H,13H2,1H3

InChIKey

InChIKey=CLKBQIFUKHNMQY-UHFFFAOYSA-N

SMILES

C(F)(F)(F)C1=CC(C(OC)=O)=CC=C1N

Canonical SMILES

O=C(OC)C1=CC=C(N)C(=C1)C(F)(F)F

Other Names for this Substance

  • Benzoic acid, 4-amino-3-(trifluoromethyl)-, methyl ester
  • Methyl 3-(trifluoromethyl)-4-aminobenzoate
  • 4-Amino-3-trifluoromethylbenzoic acid methyl ester
  • Methyl 4-amino-3-trifluoromethylbenzoate

CAS INSIGHTSTM
Targeted protein degrader structure, illustration