Basic information
- Standard SMILES
Cc1cc(C2CC3CC2CC3CCOCCC2CC3CC2CC3c2ccc(O)c(C)c2)ccc1O- InChIKey
CCQMOJHVXJNYQC-UHFFFAOYSA-N- Molecular formula
- C32H42O3
- Average molar mass
- 474.7 g/mol
- Monoisotopic mass
- 474.3133952
Names & identifiers
- Preferred name
- 4,4'-((Oxybis(ethane-2,1-diyl))bis(bicyclo[2.2.1]heptane-5,2-diyl))bis(2-methylphenol)
- IUPAC
- 4-[5-[2-[2-[5-(4-hydroxy-3-methylphenyl)-2-bicyclo[2.2.1]heptanyl]ethoxy]ethyl]-2-bicyclo[2.2.1]heptanyl]-2-methylphenol
Names & synonyms
SCHEMBL899718CCQMOJHVXJNYQC-UHFFFAOYSA-N4,4'-((oxybis(ethane-2,1-diyl))bis(bicyclo[2.2.1]heptane-5,2-diyl))bis(2-methylphenol)
Database identifiers
- PubChem CID
- 66835640
Properties
Computed structural properties
- XLogP
- 8.2
- Topological polar surface area
- 49.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 8
- Heavy atoms
- 35
- Formal charge
- 0
- Complexity
- 651
Related reactions
2 records
Compound notes
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