17811-28-8
| Name | zinniol |
| CAS | 17811-28-8 |
| Molecular Formula | C15H22O4 |
| MDL Number | MFCD03273554 |
| Molecular Weight | 266.33 |
| MOL File | 17811-28-8.mol |
Chemical Properties
| Boiling point | 425.3±40.0 °C(Predicted) |
| density | 1.106±0.06 g/cm3(Predicted) |
| storage temp. | -20°C |
| solubility | DMSO: 1mg/mL |
| form | solid |
| pka | 14.13±0.10(Predicted) |
| Major Application | metabolomics vitamins, nutraceuticals, and natural products |
| InChI | 1S/C15H22O4/c1-10(2)5-6-19-14-7-12(8-16)13(9-17)15(18-4)11(14)3/h5,7,16-17H,6,8-9H2,1-4H3 |
| InChIKey | DUMQPTRUYCCSEZ-UHFFFAOYSA-N |
| SMILES | CC(C)=CCOC1=CC(CO)=C(CO)C(OC)=C1C |
| LogP | 2.070 (est) |