ChemArche
Sign inAccount

Molecule record

3,3,3-trifluoro-1-phenylpropan-1-one

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
9834155

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-Phenyl-3,3,3-trifluoropropan-1-one
  • 1-Propanone, 3,3,3-trifluoro-1-phenyl-
  • 2,2,2-Trifluoroethyl phenyl ketone
  • 2-(trifluoromethyl)acetophenone
  • 3,3,3-Trifluoro-1-phenyl-1-propanone
  • 3,3,3-trifluoro-1-phenyl-propan-1-one
  • 709-21-7
  • 813-502-7
Show all 24 synonyms
  • AKOS009339044
  • AS-33008
  • CS-0109821
  • DB-293803
  • DTXCID70382284
  • DTXSID20431453
  • EN300-41577
  • F236875
  • MFCD00514585
  • PHENYL-2,2,2-TRIFLUOROETHYL-KETONE
  • RefChem:485043
  • SCHEMBL70367
  • SCHEMBL8438487
  • SY122266
  • trifluoromethyl acetophenon
  • trifluoromethyl acetophenone

Structure identifiers

Canonical SMILES
O=C(CC(F)(F)F)c1ccccc1
Isomeric SMILES
C1=CC=C(C=C1)C(=O)CC(F)(F)F
InChI
InChI=1S/C9H7F3O/c10-9(11,12)6-8(13)7-4-2-1-3-5-7/h1-5H,6H2
InChIKey
LBWMQVOHFPLVBY-UHFFFAOYSA-N
PubChem CID
9834155

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 3,3,3-trifluoro-1-phenylpropan-1-one; not experimental data.

Simulated EI mass spectrum

On-demand educational fragmentation for 3,3,3-trifluoro-1-phenylpropan-1-one; not experimental data.

Sources

Molecule identity

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

PubChem(link only)
Open source record