12-(2-Hydroxy-2-Propanyl)-9-Methyl-4-(3-Methyl-2-Buten-1-Yl)-3,6-Dioxo-8-Oxatricyclo[7.3.1.0~2,7~]Trideca-2(7),4-Dien-5-Yl 2-Methylpropanoate
Properties
Property | Value |
---|---|
Formula | C25H34O6 |
IUPAC Name | [(1r,9r,12s)-12-(1-hydroxy-1-methyl-ethyl)-9-methyl-4-(3-methylbut-2-enyl)-3,6-dioxo-8-oxatricyclo[7.3.1.02,7]trideca-2(7),4-dien-5-yl] 2-methylpropanoate |
Molecular Mass | 430.534 g·mol−1 |
Heat of Formation | -1093.7 ± 16.7 kJ·mol−1 |
Dipole Moment | 1.77 ± 1.08 D |
Volume | 535.33 Å 3 |
Surface Area | 421.87 Å 2 |
HOMO Energy | -9.24 ± 0.55 eV |
LUMO Energy | -1.34 ± eV |
Point Group Symmetry | C1 |
InChIKey | JTTNQUCEWDQPMF-RYUVBPIJSA-N |
QR Code | Generate QR Code |
Links | ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O |