Basic information
- Standard SMILES
O=C(O)C[C@H](S)C(=O)O- InChIKey
NJRXVEJTAYWCQJ-REOHCLBHSA-N- Molecular formula
- C4H6O4S
- Average molar mass
- 150.16 g/mol
Overview
(S)-thiomalic acid is a thiomalic acid. It is an enantiomer of a (R)-thiomalic acid.
Names & identifiers
- Preferred name
- (s)-2-Mercaptosuccinic acid
- IUPAC
- (2S)-2-sulfanylbutanedioic acid
Names & synonyms
(s)-2-mercaptosuccinic acid74708-34-2(2S)-2-sulfanylbutanedioic acid(S)-thiomalic acid(2S)-2-mercaptosuccinic acidButanedioic acid, mercapto-, (2S)-MFCD18089804NSC-41809(s)-2-mercaptosuccinicacidNCIMech_000064NCIStruc1_000627NCIStruc2_000376
Show more names
SCHEMBL2103664CHEMBL1741823CHEBI:38720NJRXVEJTAYWCQJ-REOHCLBHSA-NNCI41809CCG-35451CCG-38185NCGC00013490
Database identifiers
- PubChem CID
- 3246154
- ChEMBL
CHEMBL1741823- ChEBI
CHEBI:38720- Nikkaji
- J84.131E
Properties
Computed structural properties
- XLogP
- -0.4
- Topological polar surface area
- 75.6 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 133
Related reactions
7 records
Compound notes
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