Molecule record

1-[4-(trifluoromethyl)phenyl]ethanone

C9H7F3O

188.15 g/mol

Loading structure

Molecular properties

Formula
C9H7F3O
Molar mass
188.15 g·mol−1
Exact mass
188.0449 Da
5
PubChem CID
69731

Functional groups

Alkane / alkyl carbon
Alkyl halide
Aromatic ring
Ketone

Physical properties

No source-backed physical properties are curated for this molecule yet.

Common names and synonyms

  • 1-(4-trifluoromethyl-phenyl)-ethanone
  • 1-Acetyl-4-(trifluoromethyl)benzene
  • 1-[4-(Trifluoromethyl)phenyl]ethan-1-one
  • 211-913-0
  • 4'-(Trifluoromethyl)acetophenone
  • 4'-(Trifluoromethyl)acetophenone, 98%
  • 4-Acetylbenzotrifluoride
  • 4-CF3-C6H4-COCH3
Show all 24 synonyms
  • 4-trifluoromethyl acetophenone
  • 709-63-7
  • DTXCID80143621
  • DTXSID80221130
  • EINECS 211-913-0
  • Ethanone, 1-[4-(trifluoromethyl)phenyl]-
  • MFCD00000401
  • NCIOpen2_001487
  • NSC 88346
  • NSC88346
  • RefChem:424558
  • SCHEMBL2095081
  • SCHEMBL72091
  • TZ2PGR8637
  • UNII-TZ2PGR8637
  • p-Trifluoromethylacetophenone

Structure identifiers

Canonical SMILES
CC(=O)c1ccc(C(F)(F)F)cc1
Isomeric SMILES
CC(=O)C1=CC=C(C=C1)C(F)(F)F
InChI
InChI=1S/C9H7F3O/c1-6(13)7-2-4-8(5-3-7)9(10,11)12/h2-5H,1H3
InChIKey
HHAISVSEJFEWBZ-UHFFFAOYSA-N
PubChem CID
69731

Spectroscopy

Tabs appear only for spectra stored with clear provenance.

Open library
No redistributable or simulated spectroscopy record is attached yet.

Simulated NMR

On-demand educational prediction for 1-[4-(trifluoromethyl)phenyl]ethanone; not experimental data.

Simulated EI mass spectrum

On-demand educational fragmentation for 1-[4-(trifluoromethyl)phenyl]ethanone; not experimental data.

Sources

Molecule identity

Retrieved 8/19/2026. Reuse status is summarized by the badge; open the source for full details.

Open source record