Propanedioic acid, (dimercaptomethylene)-, bis(1-methylethyl) ester, zinc salt (2:1)
Basic information
- CAS
93914-22-8- Standard SMILES
CC(C)OC(=O)C(C(=O)OC(C)C)C(=S)[S-].CC(C)OC(=O)C(C(=O)OC(C)C)C(=S)[S-].[Zn+2]- InChIKey
QFQKNLOXOLLOOY-UHFFFAOYSA-L- Molecular formula
- C20H30O8S4Zn
- Average molar mass
- 592.1 g/mol
- Monoisotopic mass
- 590.011494
Names & identifiers
- Preferred name
- Propanedioic acid, (dimercaptomethylene)-, bis(1-methylethyl) ester, zinc salt (2:1)
- IUPAC
- zinc bis(3-oxo-3-propan-2-yloxy-2-propan-2-yloxycarbonylpropanedithioate)
Names & synonyms
93914-22-8Bis(1-methylethyl) (dimercaptomethylene)propanedioate zinc salt (2:1)Propanedioic acid, (dimercaptomethylene)-, bis(1-methylethyl) ester, zinc salt (2:1)RefChem:374455DTXSID20917202Zinc bis{3-oxo-3-[(propan-2-yl)oxy]-2-{[(propan-2-yl)oxy]carbonyl}propane(dithioate)}
Database identifiers
- CAS
93914-22-8- PubChem CID
- 44147449
- DTXSID
DTXSID20917202
Properties
Computed structural properties
- Topological polar surface area
- 171 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 12
- Rotatable bonds
- 12
- Heavy atoms
- 33
- Formal charge
- 0
- Complexity
- 259
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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