(1S,4R,5R,7S)-1-Allyl-6-(3,4-Dimethoxyphenyl)-4-Hydroxy-3-Methoxy-4,7-Dimethylbicyclo[3.2.1]Oct-2-En-8-One
Properties
| Property | Value |
|---|---|
| Formula | C22H28O5 |
| IUPAC Name | (1s,4s,5r,6r,7r)-1-allyl-6-(3,4-dimethoxyphenyl)-4-hydroxy-3-methoxy-4,7-dimethyl-bicyclo[3.2.1]oct-2-en-8-one |
| Molecular Mass | 372.455 g·mol−1 |
| Heat of Formation | -678.6 ± 16.7 kJ·mol−1 |
| Dipole Moment | 1.96 ± 1.08 D |
| Volume | 464.86 Å 3 |
| Surface Area | 378.29 Å 2 |
| HOMO Energy | -8.37 ± 0.55 eV |
| LUMO Energy | 3.22 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | JBYGAWPYVWTNRG-JGRZMLEXSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O |