Basic information
- Standard SMILES
O=C(O)CC(SC(=S)Cc1ccccc1)C(=O)O- InChIKey
GKLXTCVSRPGPBH-UHFFFAOYSA-N- Molecular formula
- C12H12O4S2
- Average molar mass
- 284.4 g/mol
Names & identifiers
- Preferred name
- 2-[(2-phenylethanethioyl)sulfanyl]succinic Acid
- IUPAC
- 2-(2-phenylethanethioyl)sulfanylbutanedioic acid
Names & synonyms
SCHEMBL3065196GKLXTCVSRPGPBH-UHFFFAOYSA-N2-[(2-phenylethanethioyl)sulfanyl]succinic Acid
Database identifiers
- PubChem CID
- 59347152
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 132 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 7
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 324
Related reactions
1 records
Compound notes
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