Basic information
- Standard SMILES
CCOc1ccc(-c2ccc(C#Cc3ccc(C)cc3)cc2)cc1- InChIKey
YANCZBVBFQOTTP-UHFFFAOYSA-N- Molecular formula
- C23H20O
- Average molar mass
- 312.4 g/mol
- Monoisotopic mass
- 312.15141526
Names & identifiers
- Preferred name
- MeP2OPPa
- IUPAC
- 1-ethoxy-4-[4-[2-(4-methylphenyl)ethynyl]phenyl]benzene
Names & synonyms
MeP2OPPaDTXSID8013822074-ethoxy-4'-(p-tolylethynyl)-1,1'-biphenyl4-ethoxy-4'-[(4-methylphenyl)ethynyl]biphenyl
Database identifiers
- PubChem CID
- 175686241
- DTXSID
DTXSID801382207
Properties
Computed structural properties
- XLogP
- 6.3
- Topological polar surface area
- 9.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 5
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 417
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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