Chem
J-GLOBAL ID：200907057902682017   Nikkaji number：J141.645F

2-(Trifluoromethyl)benzoic acid

2-(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)6-4-2-1-3-5(6)7(12)13/h1-4H,(H,12,13)
InChI key： FBRJYBGLCHWYOE-UHFFFAOYSA-N
SMILES： OC(=O)c1ccccc1C(F)(F)F
Systematic name  (4)：
  • 2-(トリフルオロメチル)安息香酸
  • 2-トリフルオロメチル安息香酸
  • o-(トリフルオロメチル)安息香酸
  • 2-(trifluoromethyl)benzoic acid
Other name (5)：
  • α,α,α-Trifluoro-o-toluic acid
  • α,α,α-トリフルオロ-o-トル酸
  • 2-Trifluoromethylbenzoic acid
  • 2-(Trifluoromethyl)benzoic acid
  • o-(Trifluoromethyl)benzoic acid
CAS registry number： 433-97-6
Regulation number (2)：
  • (3)-1414
  • EINECS2070939
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