Completing data — usually done within a minute
Basic information
- CAS
821798-76-9- Standard SMILES
CC1(CO)CC=C(c2ccc(OCc3ccccc3)cc2)CC1- InChIKey
VKFVFPDLCSTXQR-UHFFFAOYSA-N- Molecular formula
- C21H24O2
- Average molar mass
- 308.4 g/mol
- Monoisotopic mass
- 308.17763
Names & identifiers
- Preferred name
- [4-(4-Benzyloxy-phenyl)-1-methyl-cyclohex-3-enyl]-methanol
- IUPAC
- [1-methyl-4-(4-phenylmethoxyphenyl)cyclohex-3-en-1-yl]methanol
Names & synonyms
821798-76-9[4-(4-benzyloxy-phenyl)-1-methyl-cyclohex-3-enyl]-methanolSCHEMBL5382929DTXSID90593759VKFVFPDLCSTXQR-UHFFFAOYSA-N[4'-(Benzyloxy)-4-methyl-2,3,4,5-tetrahydro[1,1'-biphenyl]-4-yl]methanol[4'-(Benzyloxy)-4-methyl[2,3,4,5-tetrahydro[1,1'-biphenyl]]-4-yl]methanol
Database identifiers
- CAS
821798-76-9- PubChem CID
- 18436343
- DTXSID
DTXSID90593759
Properties
Computed structural propertiesFilling in
- XLogP
- 4.3
- Topological polar surface area
- 29.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 389
Related reactions
4 records
Compound notes
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