Dimethyl 2,3-bis(sulfanyl)butanedioate
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Basic information
- CAS
17660-57-0- Standard SMILES
COC(=O)C(S)C(S)C(=O)OC- InChIKey
VVOFTOVXFWLOAY-UHFFFAOYSA-N- Molecular formula
- C6H10O4S2
- Average molar mass
- 210.3 g/mol
- Monoisotopic mass
- 210.0020508
Names & identifiers
- Preferred name
- Dimethyl 2,3-bis(sulfanyl)butanedioate
- IUPAC
- dimethyl 2,3-bis(sulfanyl)butanedioate
- English name
- dimethyl mercaptosuccinate
- Molecular weight
- 0
Names & synonyms
dimethyl 2,3-bis(sulfanyl)butanedioate17660-57-02,3-Dimercaptosuccinic acid dimethyl esterSCHEMBL10329462Dimethyl 2,3-dimercaptosuccinateDTXSID90938823Succinic acid, 2,3-dimercapto-, dimethyl esterButanedioic acid, 2,3-dimercapto-, dimethyl esterDi-me-meso-dmsaDimercaptosuccinic acid dimethyl ester
Database identifiers
- CAS
17660-57-0- PubChem CID
- 3036650
- DTXSID
DTXSID90938823- Nikkaji
- J474.576K
Properties
Computed structural propertiesFilling in
- XLogP
- 0.7
- Topological polar surface area
- 54.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 5
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 162
Related reactions
0 records
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Compound notes
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