Basic information
- Standard SMILES
CC1(C)CC(=C(c2ccc(F)cc2)c2ccc(OCCOCCO)cc2)CC(C)(C)C1- InChIKey
YEJDPKJJWINDNR-UHFFFAOYSA-N- Molecular formula
- C27H35FO3
- Average molar mass
- 426.6 g/mol
Names & identifiers
- Preferred name
- 2-{[2-({4-[(4-Fluorophenyl)(3,3,5,5-tetramethylcyclohexylidene)methyl]phenyl}oxy)ethyl]oxy}ethanol
- IUPAC
- 2-[2-[4-[(4-fluorophenyl)-(3,3,5,5-tetramethylcyclohexylidene)methyl]phenoxy]ethoxy]ethanol
Names & synonyms
SCHEMBL3078338YEJDPKJJWINDNR-UHFFFAOYSA-N2-{[2-({4-[(4-Fluorophenyl)(3,3,5,5-tetramethylcyclohexylidene)methyl]phenyl}oxy)ethyl]oxy}ethanol
Database identifiers
- PubChem CID
- 11992568
Properties
Computed structural properties
- XLogP
- 6.5
- Topological polar surface area
- 38.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 8
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 563
Related reactions
2 records
Compound notes
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