Basic information
- CAS
75045-72-6- Standard SMILES
O=C1C2CC=CCC2C(=O)N1SC(Cl)(Cl)C(Cl)Cl.O=S(=O)([O-])[O-].[Cu+2].[OH-].[OH-].[Zn+2]- InChIKey
OACJJCYBDIYDCQ-UHFFFAOYSA-J- Molecular formula
- C10H11Cl4CuNO8S2Zn
- Average molar mass
- 608.1 g/mol
- Monoisotopic mass
- 603.726758
Names & identifiers
- Preferred name
- Zincofol
- IUPAC
- copper;zinc;2-(1,1,2,2-tetrachloroethylsulfanyl)-3a,4,7,7a-tetrahydroisoindole-1,3-dione;dihydroxide;sulfate
- English name
- ZINCOFOL
- Molecular formula
- C10H11Cl4CuNO8S2Zn
- Molecular weight
- 608.07424
Names & synonyms
Zincofol75045-72-6cis-N-((1,1,2,2-Tetrachloroethyl)thio)-4-cyclohexane with zinc and copperDTXSID00996550Sulfuric acid, zinc salt (1:1), mixt. with copper hydroxide (Cu(OH)2) and 3a,4,7,7a-tetrahydro-2-((1,1,2,2-tetrachloroethyl)thio)-1H-isoindole-1,3(2H)-dioneCopper(2+) zinc hydroxide sulfate--2-[(1,1,2,2-tetrachloroethyl)sulfanyl]-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione (1/1/2/1/1)
Database identifiers
- CAS
75045-72-6- PubChem CID
- 198569
- DTXSID
DTXSID00996550
Properties
Computed structural properties
- Topological polar surface area
- 153 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 3
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 449
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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