| Phytochemical Name : Geranyl isobutyrate |
| PCNDIDG0059 |
| Pubchem CID : 6086514 |
| Molecular formula: C14H24O2 |
| Canonical SMILES : CC(C)C(=O)OCC=C(C)CCC=C(C)C |
Synonymes : Geranyl isobutyrate|2345-26-8|FEMA No. 2513|Propanoic acid, 2-methyl-, (2E)-3,7-dimethyl-2,6-octadien-1-yl ester|Geranyl isobutyrate (natural)|(E)-3,7-Dimethylocta-2,6-dien-1-yl isobutyrate|[(2E)-3,7-dimethylocta-2,6-dienyl] 2-methylpropanoate|EINECS 219-062-7|trans-3-7-Dimethyl-2,6-octadienyl isobutyrate|AI3-32667|Isobutyric acid, 3,7-dimethyl-2,6-octadienyl ester, (E)-|Isobutyric acid, 3,7-dimethyl-2,6-octadienyl ester, trans-|UNII-P6D2F72907|3,7-Dimethyl-2,6-octadienyl isobutyrate, (E)-|Propanoic acid, 2-methyl-, 3,7-dimethyl-2,6-octadienyl ester, (E)-|3,7-Dimethyl-2,6-octadien-1-yl isobutyrate, trans-|P6D2F72907|3,7-Dimethyl-2,6-octadienyl 2-methylpropanoate, (E)-|2,6-Octadien-1-ol, 3,7-dimethyl-, isobutyrate, trans-|3,7-Dimethyl-2,6-octadien-1-yl 2-methylpropanoate, trans-|Propanoic acid, 2-methyl-, 3,7-dimethyl-2,6-octadienyl ester, (E)|Propanoic acid, 2-methyl-, (2E)-3,7-dimethyl-2,6-octadienyl ester|Geraniol isobutyrate|PROPIONIC ACID, 2-METHYL-, 3,7-DIMETHYL-2,6-OCTADIENYL ESTER, (E)|3,7-Dimethyl-2,6-octadienyl isobutyrate|NERYLISOBUTYRATE|SCHEMBL397326|SCHEMBL397327|DTXSID8051889|CHEBI:145741|GERANYL ISOBUTYRATE [FHFI]|geranyl isobutyrate, No Antioxidant|CAA34526|ISOBUTYRIC ACID, GERANYL ESTER|AKOS015837557|LS-2770|3,7-dimethyl-2,6-octadien-1-yl isobutyrate|A878237|Q27286284|Z762367552|(2E)-3,7-DIMETHYLOCTA-2,6-DIEN-1-YL 2-METHYLPROPANOATE |
| Structure | |
| 3D structure | 2D structure |
 |
| Log Po/w (iLOGP) : 3.750 |
| Log Po/w (XLOGP3) : 5.080 |
| Log Po/w (WLOGP) : 3.880 |
| Log Po/w (MLOGP) : 3.480 |
| Log Po/w (SILICOS-IT) : 3.680 |
| Consensus Log Po/w : 3.970 |