4-[4-(4-Hydroxyphenyl)-3-Hexen-3-Yl]Phenyl Hexopyranosiduronic Acid
Properties
Property | Value |
---|---|
Formula | C24H28O8 |
IUPAC Name | (2s,3s,4s,5r,6r)-6-[4-[(e)-1-ethyl-2-(4-hydroxyphenyl)but-1-enyl]phenoxy]-3,4,5-trihydroxy-tetrahydropyran-2-carboxylic acid |
Molecular Mass | 444.474 g·mol−1 |
Heat of Formation | -1287.6 ± 16.7 kJ·mol−1 |
Dipole Moment | 2.84 ± 1.08 D |
Volume | 526.77 Å 3 |
Surface Area | 437.96 Å 2 |
HOMO Energy | -9.07 ± 0.55 eV |
LUMO Energy | -0.05 ± eV |
Point Group Symmetry | C1 |
InChIKey | LJMPVHCKUXKZAV-VZVLDYGMSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O |