Basic information
- CAS
31638-66-1- Standard SMILES
[C-]#Cc1ccc(C)cc1.[Cu+]- InChIKey
JZYJSHAJKZKMJW-UHFFFAOYSA-N- Molecular formula
- C9H7Cu
- Average molar mass
- 178.7 g/mol
- Monoisotopic mass
- 177.984372
Names & identifiers
- Preferred name
- Copper, [(4-methylphenyl)ethynyl]-
- IUPAC
- copper(1+);1-ethynyl-4-methylbenzene
Names & synonyms
Copper, [(4-methylphenyl)ethynyl]-31638-66-1DTXSID90487609Copper(1+) 2-(4-methylphenyl)ethyn-1-ide
Database identifiers
- CAS
31638-66-1- PubChem CID
- 85437951
- DTXSID
DTXSID90487609
Properties
Computed structural properties
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 118
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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