2-Hydroxy-2-(4-Hydroxy-3-Methoxyphenyl)Ethyl Hexopyranosiduronic Acid
Properties
Property | Value |
---|---|
Formula | C15H20O10 |
IUPAC Name | (2s,3s,4s,5r,6r)-3,4,5-trihydroxy-6-[(2s)-2-hydroxy-2-(4-hydroxy-3-methoxy-phenyl)ethoxy]tetrahydropyran-2-carboxylic acid |
Molecular Mass | 360.313 g·mol−1 |
Heat of Formation | -1684.8 ± 16.7 kJ·mol−1 |
Dipole Moment | 3.52 ± 1.08 D |
Volume | 395.33 Å 3 |
Surface Area | 351.55 Å 2 |
HOMO Energy | -8.62 ± 0.55 eV |
LUMO Energy | 0.04 ± eV |
Point Group Symmetry | C1 |
InChIKey | JSGYXENDBAJOJI-HHVBASFHSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O |