(E)-2-[(1S,5S,7R,8S,11R)-11-(2-Hydroxy-2-Propanyl)-8-Methyl-5-(2-Oxopropyl)-4-Oxatricyclo[6.3.1.0~2,6~]Dodec-2(6)-En-7-Yl]Vinyl 3-Methyl-2-Butenoate
Properties
| Property | Value |
|---|---|
| Formula | C25H36O5 |
| IUPAC Name | [(e)-2-[(1s,5s,7r,8s,11r)-5-acetonyl-11-(1-hydroxy-1-methyl-ethyl)-8-methyl-4-oxatricyclo[6.3.1.02,6]dodec-2(6)-en-7-yl]vinyl] 3-methylbut-2-enoate |
| Molecular Mass | 416.550 g·mol−1 |
| Heat of Formation | -958.8 ± 16.7 kJ·mol−1 |
| Dipole Moment | 6.44 ± 1.08 D |
| Volume | 538.39 Å 3 |
| Surface Area | 424.16 Å 2 |
| HOMO Energy | -8.96 ± 0.55 eV |
| LUMO Energy | -0.03 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | AIMMTSCLXAKBFQ-DHZFHNNVSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O |