(3β,17Xi)-Cholest-5-En-3-Yl Octanoate
Properties
| Property | Value |
|---|---|
| Formula | C35H60O2 |
| IUPAC Name | [(3s,8s,9s,10r,13r,14s)-10,13-dimethyl-17-[(2r)-6-methylheptan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1h-cyclopenta[a]phenanthren-3-yl] octanoate |
| Molecular Mass | 512.850 g·mol−1 |
| Heat of Formation | 5273.3 ± 16.7 kJ·mol−1 |
| Dipole Moment | 23.81 ± 1.08 D |
| Volume | 546.88 Å 3 |
| Surface Area | 509.9 Å 2 |
| HOMO Energy | -7.61 ± 0.55 eV |
| LUMO Energy | -1.22 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | SKLBBRQPVZDTNM-GMPVYNJVSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | C O |