Copper, bis((C,C'-(2-(3-(oxo-kappaO)-3-(2-(oxo-kappaO)cyclopentyl)propyl)-1,4-phenylene) bis(C-ethyl carbonato))(1-))-
Basic information
- CAS
68201-66-1- Standard SMILES
CCOC(=O)Oc1cc(CC/C([O-])=C2\CCCC2=O)cc(OC(=O)OCC)c1.CCOC(=O)Oc1ccc(OC(=O)OCC)c(CC/C([O-])=C2\CCCC2=O)c1.[Cu+2]- InChIKey
VZXFJCORKUBQTJ-KYYXVASFSA-L- Molecular formula
- C40H46CuO16
- Average molar mass
- 846.3 g/mol
- Monoisotopic mass
- 845.208182
Names & identifiers
- Preferred name
- Copper, bis((C,C'-(2-(3-(oxo-kappaO)-3-(2-(oxo-kappaO)cyclopentyl)propyl)-1,4-phenylene) bis(C-ethyl carbonato))(1-))-
- IUPAC
- copper;(1Z)-3-[2,5-bis(ethoxycarbonyloxy)phenyl]-1-(2-oxocyclopentylidene)propan-1-olate;(1Z)-3-[3,5-bis(ethoxycarbonyloxy)phenyl]-1-(2-oxocyclopentylidene)propan-1-olate
Names & synonyms
EINECS 269-231-4Copper, bis((2-(3-(oxo-kappaO)-3-(2-(oxo-kappaO)cyclopentyl)propyl)-1,4-phenylene bis(ethyl carbonato))(1-))-Copper, bis((C,C'-(2-(3-(oxo-kappaO)-3-(2-(oxo-kappaO)cyclopentyl)propyl)-1,4-phenylene) bis(C-ethyl carbonato))(1-))-RefChem:579105Copper, bis[[C,C'-[2-[3-(oxo-.kappa.O)-3-[2-(oxo-.kappa.O)cyclopentyl]propyl]-1,4-phenylene] bis(C-ethyl carbonato)](1-)]-Bis((2-(3-oxo-3-(2-oxocyclopentyl)propyl)-p-phenylene bis(ethyl carbonato))(1-))copperVZXFJCORKUBQTJ-KYYXVASFSA-L
Database identifiers
- CAS
68201-66-1- PubChem CID
- 5485364
Properties
Computed structural properties
- Topological polar surface area
- 222 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 16
- Rotatable bonds
- 22
- Heavy atoms
- 57
- Formal charge
- 0
- Complexity
- 1,170
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationCopper, bis[[C,C'-[2-[3-(oxo-.kappa.O)-3-[2-(oxo-.kappa.O)cyclopentyl]propyl]-1,4-phenylene] bis(C-ethyl carbonato)](1-)]-: INACTIVE
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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