| Phytochemical Name : 1,3,3-Trimethyl-2-oxabicyclo[2.2.2]oct-5-ene |
| PCNDIDOT0328 |
| Pubchem CID : 523035 |
| Molecular formula: C10H16O |
| Canonical SMILES : CC1(C2CCC(O1)(C=C2)C)C |
Synonymes : 2,3-Dehydro-1,8-cineole|Dehydrocineole|1,3,3-Trimethyl-2-oxabicyclo[2.2.2]oct-5-ene|Dehydro-1,8-cineol|Dehydro-1,8-cineole|66113-06-2|1,8-Dehydrocineole|1,8-cineole dehydro|Dehydro-1,8-cyneole|Dehydro-1.8-cineole|2,3-Dehydro-1,8-cineol|1,8-Epoxy-p-menth-2-ene|1,8-Epoxy-p-mentha-2-ene|SCHEMBL23358702|DTXSID80335140|CHEBI:167365|1,3,3-Trimethyl-2-oxabicyclo[2.2.2]oct-5-ene #|Q67879829|92760-25-3 |
| Structure | |
| 3D structure | 2D structure |
 |
| Log Po/w (iLOGP) : 2.500 |
| Log Po/w (XLOGP3) : 1.890 |
| Log Po/w (WLOGP) : 2.520 |
| Log Po/w (MLOGP) : 2.300 |
| Log Po/w (SILICOS-IT) : 2.450 |
| Consensus Log Po/w : 2.330 |