Chem
J-GLOBAL ID：201207014136523526   Nikkaji number：J3.075.924I

2-(Phenylsulfinyl)pentanoic acid ethyl ester

2-(フェニルスルフィニル)ペンタン酸エチル
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： C13H18O3S
Molecular formula furigana： C13-H18-O3-S
Molecular weight： 254.340
InChI： InChI=1S/C13H18O3S/c1-3-8-12(13(14)16-4-2)17(15)11-9-6-5-7-10-11/h5-7,9-10,12H,3-4,8H2,1-2H3
InChI key： XPQICHOXGVXJJF-UHFFFAOYSA-N
SMILES： CCCC(C(=O)OCC)S(=O)c1ccccc1
Systematic name  (3)：
  • 2-(フェニルスルフィニル)ペンタン酸エチル
  • エチル 2-(ベンゼンスルフィニル)ペンタノアート
  • ethyl 2-(benzenesulfinyl)pentanoate
Other name (1)：
  • 2-(Phenylsulfinyl)pentanoic acid ethyl ester
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