Chem
J-GLOBAL ID：200907021907257891   Nikkaji number：J354.708F

Benzoic acid 4-(methylthio)benzyl ester

安息香酸4-(メチルチオ)ベンジル
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： C15H14O2S
Molecular formula furigana： C15-H14-O2-S
Molecular weight： 258.339
InChI： InChI=1S/C15H14O2S/c1-18-14-9-7-12(8-10-14)11-17-15(16)13-5-3-2-4-6-13/h2-10H,11H2,1H3
InChI key： PXRPPQZOKMHYRY-UHFFFAOYSA-N
SMILES： CSc1ccc(COC(=O)c2ccccc2)cc1
Systematic name  (3)：
  • 安息香酸4-(メチルチオ)ベンジル
  • [4-(メチルスルファニル)フェニル]メチル ベンゾアート
  • [4-(methylsulfanyl)phenyl]methyl benzoate
Other name (1)：
  • Benzoic acid 4-(methylthio)benzyl ester
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