Chem
J-GLOBAL ID:200907016796235083   Nikkaji number:J113.013G

3-Oxothiobutyric acid S-isopropyl ester

3-オキソチオ酪酸S-イソプロピル
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: C7H12O2S
Molecular formula furigana: C7-H12-O2-S
Molecular weight: 160.230
InChI: InChI=1S/C7H12O2S/c1-5(2)10-7(9)4-6(3)8/h5H,4H2,1-3H3
InChI key: VNWWAALNZPUNNP-UHFFFAOYSA-N
SMILES: CC(C)SC(=O)CC(=O)C
Systematic name  (3):
  • 3-オキソチオ酪酸S-イソプロピル
  • 1-(プロパン-2-イルスルファニル)ブタン-1,3-ジオン
  • 1-(propan-2-ylsulfanyl)butane-1,3-dione
Other name (1):
  • 3-Oxothiobutyric acid S-isopropyl ester
CAS registry number: 15780-62-8
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