Chem
J-GLOBAL ID：200907084127834767   Nikkaji number：J887.802A

4-(Trifluoromethyl)-L-mandelic acid

4-(トリフルオロメチル)-L-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)/t7-/m0/s1
InChI key： SDGXYUQKJPFLDG-ZETCQYMHSA-N
SMILES： O[C@H](C(=O)O)c1ccc(cc1)C(F)(F)F
Systematic name  (5)：
  • 4-(トリフルオロメチル)-L-マンデル酸
  • (S)-α-ヒドロキシ-4-(トリフルオロメチル)ベンゼン酢酸
  • (S)-ヒドロキシ[4-(トリフルオロメチル)フェニル]酢酸
  • (2S)-2-ヒドロキシ-2-[4-(トリフルオロメチル)フェニル]酢酸
  • (2S)-2-hydroxy-2-[4-(trifluoromethyl)phenyl]acetic acid
Other name (3)：
  • 4-(Trifluoromethyl)-L-mandelic acid
  • (S)-α-Hydroxy-4-(trifluoromethyl)benzeneacetic acid
  • (S)-Hydroxy[4-(trifluoromethyl)phenyl]acetic acid
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