Basic information
- CAS
62500-21-4- Standard SMILES
[C-]#CC(=O)OCC.[Cu+]- InChIKey
QWQIFSHFHUHVIR-UHFFFAOYSA-N- Molecular formula
- C5H5CuO2
- Average molar mass
- 160.64 g/mol
- Monoisotopic mass
- 159.958552
Names & identifiers
- Preferred name
- Copper, (3-ethoxy-3-oxo-1-propynyl)-
- IUPAC
- copper(1+);ethyl prop-2-ynoate
Names & synonyms
Copper, (3-ethoxy-3-oxo-1-propynyl)-62500-21-4DTXSID00487610Copper(1+) 2-(ethoxycarbonyl)ethyn-1-ide
Database identifiers
- CAS
62500-21-4- PubChem CID
- 85437952
- DTXSID
DTXSID00487610
Properties
Computed structural properties
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 8
- Formal charge
- 0
- Complexity
- 106
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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