Chem
J-GLOBAL ID：200907055089922347   Nikkaji number：J141.646D

3-(Trifluoromethyl)benzoic acid

3-(トリフルオロメチル)安息香酸
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C8H5F3O2
Molecular formula furigana： C8-H5-F3-O2
Molecular weight： 190.121
InChI： InChI=1S/C8H5F3O2/c9-8(10,11)6-3-1-2-5(4-6)7(12)13/h1-4H,(H,12,13)
InChI key： FQXQBFUUVCDIRK-UHFFFAOYSA-N
SMILES： OC(=O)c1cccc(c1)C(F)(F)F
Systematic name  (6)：
  • m-トリフルオロメチル安息香酸
  • α,α,α-トリフルオロ-m-トルイル酸
  • 3-(トリフルオロメチル)安息香酸
  • 3-トリフルオロメチル安息香酸
  • m-(トリフルオロメチル)安息香酸
Show all
Other name (5)：
  • 3-Trifluoromethylbenzoic acid
  • α,α,α-Trifluoro-m-toluic acid
  • 3-(Trifluoromethyl)benzoic acid
  • m-Trifluoromethylbenzoic acid
  • m-(Trifluoromethyl)benzoic acid
CAS registry number： 454-92-2
Regulation number (2)：
  • (3)-1414
  • EINECS2072302
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