Basic information
- Standard SMILES
CCc1ccc(-c2ccc(Cl)c(C)c2)cc1C1C(=O)C2CCC(C2)C1=O- InChIKey
KNODAFAJHNZRHW-UHFFFAOYSA-N- Molecular formula
- C23H23ClO2
- Average molar mass
- 366.9 g/mol
Names & identifiers
- Preferred name
- 3-(4'-Chloro-4-ethyl-3'-methylbiphen-3-yl)bicyclo[3.2.1]octane-2,4-dione
- IUPAC
- 3-[5-(4-chloro-3-methylphenyl)-2-ethylphenyl]bicyclo[3.2.1]octane-2,4-dione
Names & synonyms
KNODAFAJHNZRHW-UHFFFAOYSA-N3-(4'-chloro-4-ethyl-3'-methylbiphen-3-yl)bicyclo[3.2.1]octane-2,4-dione
Database identifiers
- PubChem CID
- 90700514
Properties
Computed structural properties
- XLogP
- 5.7
- Topological polar surface area
- 34.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 536
Related reactions
1 records
Compound notes
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