Basic information
- CAS
6966-69-4- Standard SMILES
Cc1cc(CC(C)C2CCC(C)C(c3ccc(O)c(C)c3)C2)ccc1O- InChIKey
VLPXHDDRKFSEFV-UHFFFAOYSA-N- Molecular formula
- C24H32O2
- Average molar mass
- 352.5 g/mol
- Monoisotopic mass
- 352.24023026
Names & identifiers
- Preferred name
- 4-{2-[3-(4-Hydroxy-3-methylphenyl)-4-methylcyclohexyl]propyl}-2-methylphenol
- IUPAC
- 4-[2-[3-(4-hydroxy-3-methylphenyl)-4-methylcyclohexyl]propyl]-2-methylphenol
Names & synonyms
6966-69-4NSC680544-{2-[3-(4-hydroxy-3-methylphenyl)-4-methylcyclohexyl]propyl}-2-methylphenolCHEMBL1926992DTXSID90989794NSC-68054
Database identifiers
- CAS
6966-69-4- PubChem CID
- 249598
- DTXSID
DTXSID90989794- ChEMBL
CHEMBL1926992
Properties
Computed structural properties
- XLogP
- 7.2
- Topological polar surface area
- 40.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 436
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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