Basic information
- Standard SMILES
O=C1CCCCc2ccc(OCc3ccc(-c4ccccc4)cc3)cc21- InChIKey
OZFLXWBYCOOEMN-UHFFFAOYSA-N- Molecular formula
- C24H22O2
- Average molar mass
- 342.4 g/mol
Names & identifiers
- Preferred name
- 3-(4-phenylbenzyloxy)-5-oxo-6,7,8,9-tetrahydro-5H-benzocycloheptene
- IUPAC
- 3-[(4-phenylphenyl)methoxy]-6,7,8,9-tetrahydrobenzo[7]annulen-5-one
Names & synonyms
SCHEMBL7218099OZFLXWBYCOOEMN-UHFFFAOYSA-N3-(4-phenylbenzyloxy)-5-oxo-6,7,8,9-tetrahydro-5H-benzocycloheptene
Database identifiers
- PubChem CID
- 22989972
Properties
Computed structural properties
- XLogP
- 5.7
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 445
Related reactions
4 records
Compound notes
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