2,3,4-Trihydroxyestra-1,3,5(10)-Trien-17-One
Properties
Property | Value |
---|---|
Formula | C18H22O4 |
IUPAC Name | (8r,9s,13r,14s)-2,3,4-trihydroxy-13-methyl-7,8,9,11,12,14,15,16-octahydro-6h-cyclopenta[a]phenanthren-17-one |
Molecular Mass | 302.365 g·mol−1 |
Heat of Formation | -723.6 ± 16.7 kJ·mol−1 |
Dipole Moment | 3.92 ± 1.08 D |
Volume | 357.67 Å 3 |
Surface Area | 300.23 Å 2 |
HOMO Energy | -8.55 ± 0.55 eV |
LUMO Energy | 3.12 ± eV |
Point Group Symmetry | C1 |
InChIKey | JHMKRVZOGMNBGV-UVIANQDRSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O |