Basic information
- Standard SMILES
CC1(C)C=C(c2ccc(OCc3ccccc3)cc2)CC(C)(C)C1- InChIKey
LNKBNDJFNLRYEK-UHFFFAOYSA-N- Molecular formula
- C23H28O
- Average molar mass
- 320.5 g/mol
- Monoisotopic mass
- 320.21401551
Names & identifiers
- Preferred name
- 1-Benzyloxy-4-(3,3,5,5-tetramethyl-cyclohex-1-enyl)-benzene
- IUPAC
- 1-phenylmethoxy-4-(3,3,5,5-tetramethylcyclohexen-1-yl)benzene
Names & synonyms
SCHEMBL3138740LNKBNDJFNLRYEK-UHFFFAOYSA-NDB-1027791-benzyloxy-4-(3,3,5,5-tetramethyl-cyclohex-1-enyl)-benzene1058160-05-6
Database identifiers
- PubChem CID
- 68525815
Properties
Computed structural properties
- XLogP
- 6.6
- Topological polar surface area
- 9.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 4
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 431
Related reactions
1 records
Compound notes
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