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Molecule record

3-(trifluoromethyl)benzamide

C8H6F3NO

189.14 g/mol

Loading structure

Molecular properties

Formula
C8H6F3NO
Molar mass
189.14 g·mol−1
Exact mass
189.0401 Da
5
PubChem CID
74535

Functional groups

Alkane / alkyl carbon
Alkyl halide
Amide
Aromatic ring
Primary amine

Physical properties

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

Common names and synonyms

  • 1801-10-1
  • 217-289-6
  • 3-(Trifluoromethyl)benzamide, 98%
  • 3-trifluoromethyl-benzamide
  • Benzamide, 3-(trifluoromethyl)-
  • DTXCID7093404
  • DTXSID40170913
  • EINECS 217-289-6
Show all 24 synonyms
  • FT-0613921
  • LGXSHJOWPUZRHC-UHFFFAOYSA-N
  • LLAINNZSMCUMSF-UHFFFAOYSA-N
  • MFCD00014802
  • RefChem:800334
  • SBB002332
  • SCHEMBL10012116
  • SCHEMBL171684
  • SCHEMBL27621589
  • SCHEMBL350153
  • SCHEMBL3940051
  • SCHEMBL5780333
  • STK794682
  • Z33546480
  • alpha,alpha,alpha-Trifluoro-m-toluamide
  • m-(Trifluoromethyl)benzamide

Structure identifiers

Canonical SMILES
NC(=O)c1cccc(C(F)(F)F)c1
Isomeric SMILES
C1=CC(=CC(=C1)C(F)(F)F)C(=O)N
InChI
InChI=1S/C8H6F3NO/c9-8(10,11)6-3-1-2-5(4-6)7(12)13/h1-4H,(H2,12,13)
InChIKey
XBGXGCOLWCMVOI-UHFFFAOYSA-N
PubChem CID
74535

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-(trifluoromethyl)benzamide; not experimental data.

Simulated EI mass spectrum

On-demand educational fragmentation for 3-(trifluoromethyl)benzamide; not experimental data.

Sources

Molecule identity

Retrieved 8/20/2026. Reuse status is summarized by the badge; open the source for full details.

PubChem(link only)
Open source record