1-[2-Amino-5-(trifluoromethyl)phenyl]-2,2,2-trifluoroethanone

CAS Registry Number®

489429-73-4

CAS Name

1-[2-Amino-5-(trifluoromethyl)phenyl]-2,2,2-trifluoroethanone

Molecular Formula

C9H5F6NO

Molecular Mass

257.13

Cite this Page

1-[2-Amino-5-(trifluoromethyl)phenyl]-2,2,2-trifluoroethanone.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=489429-73-4 (retrieved 2024-10-05) (CAS RN: 489429-73-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    270-271 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C9H5F6NO/c10-8(11,12)4-1-2-6(16)5(3-4)7(17)9(13,14)15/h1-3H,16H2

InChIKey

InChIKey=GKGJOBCKNGVLON-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

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

Other Names for this Substance

  • Ethanone, 1-[2-amino-5-(trifluoromethyl)phenyl]-2,2,2-trifluoro-
  • 1-[2-Amino-5-(trifluoromethyl)phenyl]-2,2,2-trifluoroethanone
  • 1-[2-Amino-5-(trifluoromethyl)phenyl]-2,2,2-trifluoroethan-1-one

CAS INSIGHTSTM
© Nobel Prize Outreach. Photo: Hugh Fox