| Phytochemical Name : Bicyclo(3.1.1)heptan-3-ol, 6,6-dimethyl-2-methylene-, acetate, (1R,3R,5R)- |
| PCNDIDB0103 |
| Pubchem CID : 162395 |
| Molecular formula: C12H18O2 |
| Canonical SMILES : CC(=O)OC1CC2CC(C1=C)C2(C)C |
Synonymes : 39776-85-7|Pinocarvyl acetate, cis-|EINECS 254-628-7|H1VHH1X63I|Y2YP70W5TO|Fema No. 4807, cis-|Bicyclo(3.1.1)heptan-3-ol, 6,6-dimethyl-2-methylene-, acetate, (1R,3R,5R)-|Bicyclo(3.1.1)heptan-3-ol, 6,6-dimethyl-2-methylene-, 3-acetate, (1R,3R,5R)-|Bicyclo(3.1.1)heptan-3-ol, 6,6-dimethyl-2-methylene-, 3-acetate, (1R,3R,5R)-rel-|Bicyclo[3.1.1]heptan-3-ol, 6,6-dimethyl-2-methylene-, acetate, (1R,3R,5R)-|73366-18-4|(1R-(1alpha,3beta,5alpha))-6,6-Dimethyl-2-methylenebicyclo(3.1.1)hept-3-yl acetate|[1R-(1alpha,3beta,5alpha)]-6,6-dimethyl-2-methylenebicyclo[3.1.1]hept-3-yl acetate|Bicyclo[3.1.1]heptan-3-ol, 6,6-dimethyl-2-methylene-, 3-acetate, (1R,3R,5R)-|trans-Pinocarveyl acetate|UNII-H1VHH1X63I|UNII-Y2YP70W5TO|DTXSID801141926|Bicyclo(3.1.1)heptan-3-ol, 6,6-dimethyl-2-methylene-, acetate, (1R-(1alpha,3beta,5alpha))-|Bicyclo[3.1.1]heptan-3-ol, 6,6-dimethyl-2-methylene-, acetate, [1R-(1.alpha.,3.beta.,5.alpha.)]-|PINOCARVYL ACETATE, CIS-(-)-|FEMA NO. 4807, CIS-(-)-|(1R,1beta,5beta)-6,6-Dimethyl-2-methylenebicyclo[3.1.1]heptan-3alpha-ol acetate|Bicyclo(3.1.1)heptan-3-ol, 6,6-dimethyl-2-methylene-, acetate, (1theta-(1alpha,3beta,5alpha))- |
| Structure | |
| 3D structure | 2D structure |
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| Log Po/w (iLOGP) : 2.840 |
| Log Po/w (XLOGP3) : 2.360 |
| Log Po/w (WLOGP) : 2.540 |
| Log Po/w (MLOGP) : 2.650 |
| Log Po/w (SILICOS-IT) : 2.540 |
| Consensus Log Po/w : 2.590 |