| Phytochemical Name : (+)-Linalyl acetate |
| PCNDIDOT0050 |
| Pubchem CID : 6999980 |
| Molecular formula: C12H20O2 |
| Canonical SMILES : CC(=CCCC(C)(C=C)OC(=O)C)C |
Synonymes : (+)-linalyl acetate|(s)-linalyl acetate|Linalyl acetate, (+)-|51685-40-6|UNII-3ID3M89AV9|3ID3M89AV9|(3S)-3,7-dimethylocta-1,6-dien-3-yl acetate|[(3S)-3,7-dimethylocta-1,6-dien-3-yl] acetate|EINECS 257-347-8|(+)-1,5-Dimethyl-1-vinylhex-4-enyl acetate|Coriandrol acetate|S-(+)-LINALYL ACETATE|SCHEMBL15745424|CHEBI:78335|Q27147766|1,6-Octadien-3-ol, 3,7-dimethyl-, acetate, (3S)-|1,6-OCTADIEN-3-OL, 3,7-DIMETHYL-, ACETATE, (S)-|1,6-OCTADIEN-3-OL, 3,7-DIMETHYL-, 3-ACETATE, (3S)- |
| Structure | |
| 3D structure | 2D structure |
 |
| Log Po/w (iLOGP) : 3.080 |
| Log Po/w (XLOGP3) : 3.930 |
| Log Po/w (WLOGP) : 3.240 |
| Log Po/w (MLOGP) : 2.950 |
| Log Po/w (SILICOS-IT) : 2.980 |
| Consensus Log Po/w : 3.240 |