| Phytochemical Name : Menthyl valerate |
| PCNDIDM0046 |
| Pubchem CID : 78941 |
| Molecular formula: C15H28O2 |
| Canonical SMILES : CCCCC(=O)OC1CC(CCC1C(C)C)C |
Synonymes : Menthyl valerate|(1.alpha.,2.beta.,5.alpha.)-3-Methylbutanoic acid 5-methyl-2-(1-methylethyl)cyclohexyl ester|Butanoic acid, 3-methyl-, 5-methyl-2-(1-methylethyl)cyclohexyl ester, (1.alpha.,2.beta.,5.alpha.)-|Menthylvalerianat|5-methyl-2-(propan-2-yl)cyclohexyl pentanoate|NSC167384|MENTHYL PENTANOATE|(5-methyl-2-propan-2-ylcyclohexyl) pentanoate|SCHEMBL669485|DTXSID10275767|NSC-167384|2-Isopropyl-5-methylcyclohexyl pentanoate # |
| Structure | |
| 3D structure | 2D structure |
 |
| Log Po/w (iLOGP) : 3.770 |
| Log Po/w (XLOGP3) : 5.370 |
| Log Po/w (WLOGP) : 4.180 |
| Log Po/w (MLOGP) : 3.550 |
| Log Po/w (SILICOS-IT) : 3.670 |
| Consensus Log Po/w : 4.110 |