| Phytochemical Name : cis,trans,cis-1,2,4-Trimethylcyclohexane |
| PCNDIDC0174 |
| Pubchem CID : 12536912 |
| Molecular formula: C9H18 |
| Canonical SMILES : CC1CCC(C(C1)C)C |
Synonymes : (1S,2S,4R)-1,2,4-TRIMETHYLCYCLOHEXANE|CIS,TRANS,CIS-1,2,4-TRIMETHYLCYCLOHEXANE|7667-59-6|PENTAFLUOROPHENACYLBROMIDE|DTXSID401025637|r-1, t-2, c-4-trimethylcyclohexane|AKOS006273842|Cyclohexane, 1,2,4-trimethyl-, trans,trans-|(1alpha,2beta,4alpha)-1,2,4-Trimethylcyclohexane |
| Structure | |
| 3D structure | 2D structure |
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| Log Po/w (iLOGP) : 2.660 |
| Log Po/w (XLOGP3) : 4.010 |
| Log Po/w (WLOGP) : 3.080 |
| Log Po/w (MLOGP) : 4.130 |
| Log Po/w (SILICOS-IT) : 2.530 |
| Consensus Log Po/w : 3.280 |