Chem
J-GLOBAL ID：200907018760355093   Nikkaji number：J433.794H

3-(p-Tolylsulfonyl)-2-methylpropanoic acid methyl ester

3-(p-トリルスルホニル)-2-メチルプロパン酸メチル
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： C12H16O4S
Molecular formula furigana： C12-H16-O4-S
Molecular weight： 256.320
InChI： InChI=1S/C12H16O4S/c1-9-4-6-11(7-5-9)17(14,15)8-10(2)12(13)16-3/h4-7,10H,8H2,1-3H3
InChI key： ABJISGAJTYFARS-UHFFFAOYSA-N
SMILES： COC(=O)C(C)CS(=O)(=O)c1ccc(C)cc1
Systematic name  (3)：
  • 3-(p-トリルスルホニル)-2-メチルプロパン酸メチル
  • メチル 2-メチル-3-(4-メチルベンゼンスルホニル)プロパノアート
  • methyl 2-methyl-3-(4-methylbenzenesulfonyl)propanoate
Other name (1)：
  • 3-(p-Tolylsulfonyl)-2-methylpropanoic acid methyl ester
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