9,10-Secocholesta-5,7,10-Trien-3-Yl Butyrate
Properties
| Property | Value |
|---|---|
| Formula | C31H50O2 |
| IUPAC Name | [(1r,3z)-3-[(2e)-2-[(1s,3as,7ar)-1-[(1r)-1,5-dimethylhexyl]-7a-methyl-2,3,3a,5,6,7-hexahydro-1h-inden-4-ylidene]ethylidene]-4-methylene-cyclohexyl] butanoate |
| Molecular Mass | 454.727 g·mol−1 |
| Heat of Formation | -570.1 ± 16.7 kJ·mol−1 |
| Dipole Moment | 3.52 ± 1.08 D |
| Volume | 635.05 Å 3 |
| Surface Area | 524.23 Å 2 |
| HOMO Energy | -8.31 ± 0.55 eV |
| LUMO Energy | 3.41 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | QUUDUVNKJWQDFG-DZNVAQRESA-N |
| QR Code | Generate QR Code |
| Links | ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O |