Chem
J-GLOBAL ID:200907010412892602   Nikkaji number:J213.633C

4-Trifluoromethylmandelic acid

4-トリフルオロメチルマンデル酸
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: C9H7F3O3
Molecular formula furigana: C9-H7-F3-O3
Molecular weight: 220.147
InChI: InChI=1S/C9H7F3O3/c10-9(11,12)6-3-1-5(2-4-6)7(13)8(14)15/h1-4,7,13H,(H,14,15)
InChI key: SDGXYUQKJPFLDG-UHFFFAOYSA-N
SMILES: OC(C(=O)O)c1ccc(cc1)C(F)(F)F
Systematic name  (9):
  • α-ヒドロキシ-4-(トリフルオロメチル)ベンゼン酢酸
  • 4-(トリフルオロメチル)-α-ヒドロキシベンゼン酢酸
  • ヒドロキシ[4-(トリフルオロメチル)フェニル]酢酸
  • ヒドロキシ4-(トリフルオロメチル)フェニル酢酸
  • [4-(トリフルオロメチル)フェニル]ヒドロキシ酢酸
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Other name (14):
  • α-Hydroxy-4-(trifluoromethyl)benzeneacetic acid
  • 4-トリフルオロメチルマンデル酸
  • p-トリフルオロメチルマンデル酸
  • 4-Trifluoromethylmandelic acid
  • p-Trifluoromethylmandelic acid
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CAS registry number: 395-35-7
Regulation number (1):
  • EINECS2069001
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