(1S,3R,4R,5R)-1,3-Bis{[(2E)-3-(3,4-Dihydroxyphenyl)-2-Propenoyl]Oxy}-4,5-Dihydroxycyclohexanecarboxylic Acid
Properties
| Property | Value |
|---|---|
| Formula | C25H24O12 |
| IUPAC Name | (1s,3s,4r,5r)-1,3-bis[[(e)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy]-4,5-dihydroxy-cyclohexanecarboxylic acid |
| Molecular Mass | 516.451 g·mol−1 |
| Heat of Formation | -1938.3 ± 16.7 kJ·mol−1 |
| Dipole Moment | 3.18 ± 1.08 D |
| Volume | 567.5 Å 3 |
| Surface Area | 418.22 Å 2 |
| HOMO Energy | -9.07 ± 0.55 eV |
| LUMO Energy | -1.19 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | YDDUMTOHNYZQPO-BVZNTSJQSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O |