3,17-Diacetoxyestra-1(10),2,4-Triene-2-Carboxylic Acid
Properties
Property | Value |
---|---|
Formula | C23H28O6 |
IUPAC Name | (8r,9s,13s,14s,17s)-3,17-diacetoxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-2-carboxylic acid |
Molecular Mass | 400.465 g·mol−1 |
Heat of Formation | -1172.0 ± 16.7 kJ·mol−1 |
Dipole Moment | 1.41 ± 1.08 D |
Volume | 472.3 Å 3 |
Surface Area | 395.47 Å 2 |
HOMO Energy | -9.40 ± 0.55 eV |
LUMO Energy | -0.63 ± eV |
Point Group Symmetry | C1 |
Synonyms |
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InChIKey | AJVPDNOSAQOXAN-AFOZMUHCSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O |