| Phytochemical Name : (3R-trans)-3-Methyl-6-(1-methylvinyl)cyclohexene |
| PCNDIDOT0163 |
| Pubchem CID : 78790 |
| Molecular formula: C10H16 |
| Canonical SMILES : CC1CCC(C=C1)C(=C)C |
Synonymes : 5113-87-1|(1R)-(+)-trans-Isolimonene|(+)-trans-Isolimonene|(3R-trans)-3-Methyl-6-(1-methylvinyl)cyclohexene|(3R,6R)-3-methyl-6-prop-1-en-2-ylcyclohexene|EINECS 225-843-3|Cyclohexene, 3-methyl-6-(1-methylethenyl)-, (3R-trans)-|p-Mentha-2,8-diene, (1R,4R)-(+)-|Isolimonene, trans-(+)-|(+)-3R-trans-Isolimonene|(+)-(1R,4R)-trans-Isolimonene|(1R)-trans-isolimonene|3-Isopropenyl-6-methyl-1-cyclohexene-, (3R-trans)-|CHEBI:90014|DTXSID70199152|HY-N7250|AKOS017343718|p-Mentha-2,8-diene, (1R,4R)-()-|CS-0110667|(3r-trans)-3-methyl-6-(1-methylethenyl) cyclohexene|(3R-trans)-3-methyl-6-(1-methylethenyl)cyclohexene|(3R,6R)-3-methyl-6-(prop-1-en-2-yl)cyclohex-1-ene|(1R)-(+)-trans-Isolimonene, >=95.0% (sum of enantiomers, GC) |
| Structure | |
| 3D structure | 2D structure |
 |
| Log Po/w (iLOGP) : 2.700 |
| Log Po/w (XLOGP3) : 4.020 |
| Log Po/w (WLOGP) : 3.160 |
| Log Po/w (MLOGP) : 3.270 |
| Log Po/w (SILICOS-IT) : 2.570 |
| Consensus Log Po/w : 3.140 |