Chem
J-GLOBAL ID：200907079925736738   Nikkaji number：J958.099I

2-(2-Carboxyethylthio)succinic acid

カルボキシエチルチオこはく酸
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： C7H10O6S
Molecular formula furigana： C7-H10-O6-S
Molecular weight： 222.210
InChI： InChI=1S/C7H10O6S/c8-5(9)1-2-14-4(7(12)13)3-6(10)11/h4H,1-3H2,(H,8,9)(H,10,11)(H,12,13)
InChI key： NBQUSFCQEVKHCT-UHFFFAOYSA-N
SMILES： OC(=O)CCSC(CC(=O)O)C(=O)O
Systematic name  (7)：
  • 2-[(2-カルボキシエチル)チオ]こはく酸
  • 2-(2-カルボキシエチルチオ)こはく酸
  • 2-[(3-オキソ-3-ヒドロキシプロピル)チオ]こはく酸
  • 2-[(3-ヒドロキシ-3-オキソプロピル)チオ]こはく酸
  • 3-チアペンタン-1,2,5-トリカルボン酸
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Other name (7)：
  • 3-Thiapentane-1,2,5-tricarboxylic acid
  • 2-[(3-Hydroxy-3-oxopropyl)thio]succinic acid
  • 2-[(3-Oxo-3-hydroxypropyl)thio]succinic acid
  • 2-(2-Carboxyethylthio)succinic acid
  • 2-[(2-Carboxyethyl)thio]succinic acid
Show all
CAS registry number： 19343-85-2
Regulation number (2)：
  • 2-(4)-963
  • (2)-3822
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