6-(Hydroxymethyl)-2-(4-Methoxyphenyl)-3-Methylhexahydro-4Ah-Pyrano[2,3-B][1,4]Dioxine-7,8-Diol
Properties
Property | Value |
---|---|
Formula | C16H22O7 |
IUPAC Name | (2s,3s,4as,6r,7s,8s,8as)-6-(hydroxymethyl)-2-(4-methoxyphenyl)-3-methyl-3,4a,6,7,8,8a-hexahydro-2h-pyrano[2,3-b][1,4]dioxine-7,8-diol |
Molecular Mass | 326.342 g·mol−1 |
Heat of Formation | -1145.6 ± 16.7 kJ·mol−1 |
Dipole Moment | 3.50 ± 1.08 D |
Volume | 371.31 Å 3 |
Surface Area | 321.01 Å 2 |
HOMO Energy | -9.03 ± 0.55 eV |
LUMO Energy | 0.11 ± eV |
Point Group Symmetry | C1 |
InChIKey | USUWYXHMWYBKFQ-VKUPVEMESA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O |