(3R,4As)-4A-Hydroxy-3-(2-Hydroxy-3,4-Dimethoxyphenyl)-2,3,4,4A,5,6-Hexahydro-7H-Chromen-7-One
Properties
Property | Value |
---|---|
Formula | C17H20O6 |
IUPAC Name | (3r,4as)-4a-hydroxy-3-(2-hydroxy-3,4-dimethoxy-phenyl)-3,4,5,6-tetrahydro-2h-chromen-7-one |
Molecular Mass | 320.337 g·mol−1 |
Heat of Formation | -894.9 ± 16.7 kJ·mol−1 |
Dipole Moment | 8.15 ± 1.08 D |
Volume | 365.72 Å 3 |
Surface Area | 321.47 Å 2 |
HOMO Energy | -9.08 ± 0.55 eV |
LUMO Energy | -0.14 ± eV |
Point Group Symmetry | C1 |
InChIKey | WOKRCELVQNEUAD-BTDLBPIBSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O |