8-Hydroxy-7-Isopropyl-6-Methoxy-1,4A-Dimethyl-3,4,4A,9,10,10A-Hexahydro-2-Phenanthrenecarboxylic Acid
Properties
Property | Value |
---|---|
Formula | C21H28O4 |
IUPAC Name | (4as,10ar)-8-hydroxy-7-isopropyl-6-methoxy-1,4a-dimethyl-4,9,10,10a-tetrahydro-3h-phenanthrene-2-carboxylic acid |
Molecular Mass | 344.445 g·mol−1 |
Heat of Formation | -790.9 ± 16.7 kJ·mol−1 |
Dipole Moment | 3.26 ± 1.08 D |
Volume | 428.23 Å 3 |
Surface Area | 343.77 Å 2 |
HOMO Energy | -8.65 ± 0.55 eV |
LUMO Energy | 0.10 ± eV |
Point Group Symmetry | C1 |
InChIKey | GEFDLNPXEXVTCP-VFNWGFHPSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O |