(2S,4S,5R,6S)-5,12-Diacetoxy-2,4-Dihydroxy-2,6,10,10-Tetramethyl-11-Oxatricyclo[7.2.1.0~1,6~]Dodecane-7,8-Diyl Dibenzoate
Properties
| Property | Value |
|---|---|
| Formula | C33H38O11 |
| IUPAC Name | [(1s,2r,4r,5s,6r,7s,8r,9r,12r)-5,12-diacetoxy-7-benzoyloxy-2,4-dihydroxy-2,6,10,10-tetramethyl-11-oxatricyclo[7.2.1.01,6]dodecan-8-yl] benzoate |
| Molecular Mass | 610.648 g·mol−1 |
| Heat of Formation | -1881.7 ± 16.7 kJ·mol−1 |
| Dipole Moment | 9.21 ± 1.08 D |
| Volume | 696.89 Å 3 |
| Surface Area | 458.96 Å 2 |
| HOMO Energy | -9.79 ± 0.55 eV |
| LUMO Energy | 1.81 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | FOIOSVGAFMLLDU-YYHRZRPJSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O |