| Phytochemical Name : Carpacin |
| PCNDIDC0057 |
| Pubchem CID : 5281763 |
| Molecular formula: C11H12O3 |
| Canonical SMILES : CC=CC1=CC2=C(C=C1OC)OCO2 |
Synonymes : Carpacin|(E)-Carpacin|Carpacin, (E)-|194605-01-1|Z52RCE6A8B|1,3-Benzodioxole, 5-methoxy-6-(1E)-1-propenyl-|UNII-Z52RCE6A8B|C10435|5-Methoxy-6-(1-propen-1-yl)-1,3-benzodioxole|1,3-Benzodioxole, 5-methoxy-6-(1-propen-1-yl)-|5-methoxy-6-[(E)-prop-1-enyl]-1,3-benzodioxole|5-Methoxy-6-(1E)-1-propen-1-yl-1,3-benzodioxole|1,3-Benzodioxole, 5-methoxy-6-(1-propenyl)-, (E)-|1,3-Benzodioxole, 5-methoxy-6-(1E)-1-propen-1-yl-|AC1NQZ15|CHEBI:3432|DTXSID801027180|Q5045595|5-Methoxy-6-[(1E)-1-propen-1-yl]-1,3-benzodioxole |
| Structure | |
| 3D structure | 2D structure |
 |
| Log Po/w (iLOGP) : 2.810 |
| Log Po/w (XLOGP3) : 2.710 |
| Log Po/w (WLOGP) : 2.350 |
| Log Po/w (MLOGP) : 1.700 |
| Log Po/w (SILICOS-IT) : 2.820 |
| Consensus Log Po/w : 2.480 |