(3R,5S)-3,5-Bis{[(2E)-3-(3,4-Dihydroxyphenyl)-2-Propenoyl]Oxy}-1,4-Dihydroxycyclohexanecarboxylic Acid
Properties
| Property | Value |
|---|---|
| Formula | C25H24O12 |
| IUPAC Name | (3s,5r)-3,5-bis[[(e)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy]-1,4-dihydroxy-cyclohexanecarboxylic acid |
| Molecular Mass | 516.451 g·mol−1 |
| Heat of Formation | -1864.9 ± 16.7 kJ·mol−1 |
| Dipole Moment | 4.24 ± 1.08 D |
| Volume | 570.68 Å 3 |
| Surface Area | 508.8 Å 2 |
| HOMO Energy | -9.00 ± 0.55 eV |
| LUMO Energy | -1.02 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | KRZBCHWVBQOTNZ-KZIMDKONSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O |