(8Xi,9Xi,14Xi)-3-Hydroxyestra-1,3,5(10)-Trien-17-Yl 3-Cyclopentylpropanoate
Properties
Property | Value |
---|---|
Formula | C26H36O3 |
IUPAC Name | [(8s,9s,13s,14r,17s)-3-hydroxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl] 3-cyclopentylpropanoate |
Molecular Mass | 396.562 g·mol−1 |
Heat of Formation | -722.2 ± 16.7 kJ·mol−1 |
Dipole Moment | 3.44 ± 1.08 D |
Volume | 512.78 Å 3 |
Surface Area | 387.92 Å 2 |
HOMO Energy | -8.82 ± 0.55 eV |
LUMO Energy | 0.19 ± eV |
Point Group Symmetry | C1 |
InChIKey | UOACKFBJUYNSLK-OXCVBPRPSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O |