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Basic information
- Standard SMILES
COC(=O)CCCCC(=O)C=Cc1ccccc1OCc1ccc(C2CCCCC2)cc1- InChIKey
WMVSLHHMQJCYNI-UHFFFAOYSA-N- Molecular formula
- C28H34O4
- Average molar mass
- 434.6 g/mol
- Monoisotopic mass
- 434.24570956
Names & identifiers
- Preferred name
- Methyl 8-[2-[(4-cyclohexylphenyl)methoxy]phenyl]-6-oxooct-7-enoate
- IUPAC
- methyl 8-[2-[(4-cyclohexylphenyl)methoxy]phenyl]-6-oxooct-7-enoate
Database identifiers
- PubChem CID
- 72531628
Properties
Computed structural propertiesFilling in
- XLogP
- 6.5
- Topological polar surface area
- 52.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 12
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 584
Related reactions
2 records
Compound notes
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