(2E)-1-[(1S,4S,6S,10R,12S)-4,12-Dimethyl-9-Methylene-5-Oxatricyclo[8.2.0.0~4,6~]Dodec-12-Yl]-4-Hydroxy-4-Methyl-2-Penten-1-One
Properties
| Property | Value |
|---|---|
| Formula | C20H30O3 |
| IUPAC Name | (2e)-1-[(1s,4s,6s,10r,12s)-4,12-dimethyl-9-methylene-5-oxatricyclo[8.2.0.0 4,6 ]dodec-12-yl]-4-hydroxy-4-methyl-2-penten-1-one |
| Molecular Mass | 318.450 g·mol−1 |
| Heat of Formation | -447.8 ± 16.7 kJ·mol−1 |
| Dipole Moment | 5.82 ± 1.08 D |
| Volume | 425.07 Å 3 |
| Surface Area | 344.54 Å 2 |
| HOMO Energy | -9.68 ± 0.55 eV |
| LUMO Energy | -0.21 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | ZADUJBOYWSBTGW-JQVHTRMZSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O |