Basic information
- Standard SMILES
CC1(C)CC(=C(c2ccc(O)cc2)c2ccc(OCCO)cc2)CC(C)(C)C1- InChIKey
PKKRRWSNZMRZIB-UHFFFAOYSA-N- Molecular formula
- C25H32O3
- Average molar mass
- 380.5 g/mol
- Monoisotopic mass
- 380.23514488
Names & identifiers
- Preferred name
- 4-[{4-[(2-Hydroxyethyl)oxy]phenyl}(3,3,5,5-tetramethylcyclohexylidene)methyl]phenol
- IUPAC
- 4-[[4-(2-hydroxyethoxy)phenyl]-(3,3,5,5-tetramethylcyclohexylidene)methyl]phenol
Names & synonyms
SCHEMBL3468515PKKRRWSNZMRZIB-UHFFFAOYSA-N4-[{4-[(2-Hydroxyethyl)oxy]phenyl}(3,3,5,5-tetramethylcyclohexylidene)methyl]phenol
Database identifiers
- PubChem CID
- 11269007
Properties
Computed structural properties
- XLogP
- 6.2
- Topological polar surface area
- 49.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 514
Related reactions
4 records
Compound notes
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