1,5-Anhydro-6-O-(3,4,5-Trihydroxybenzoyl)-D-Glucitol
Properties
| Property | Value |
|---|---|
| Formula | C13H16O9 |
| IUPAC Name | [(2r,3s,4r,5s)-3,4,5-trihydroxytetrahydropyran-2-yl]methyl 3,4,5-trihydroxybenzoate |
| Molecular Mass | 316.261 g·mol−1 |
| Heat of Formation | -1519.2 ± 16.7 kJ·mol−1 |
| Dipole Moment | 1.52 ± 1.08 D |
| Volume | 338.89 Å 3 |
| Surface Area | 300.85 Å 2 |
| HOMO Energy | -9.16 ± 0.55 eV |
| LUMO Energy | -0.79 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | NUVIRDWXIBOJTE-LUTQBAROSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O |