(1S)-1,5-Anhydro-1-(3-Chloro-2-Hydroxy-5-Methoxyphenyl)-D-Glucitol
Properties
| Property | Value |
|---|---|
| Formula | C13H17ClO7 |
| IUPAC Name | (2s,3r,4r,5s,6r)-2-(3-chloro-2-hydroxy-5-methoxy-phenyl)-6-(hydroxymethyl)tetrahydropyran-3,4,5-triol |
| Molecular Mass | 320.723 g·mol−1 |
| Heat of Formation | -1234.4 ± 16.7 kJ·mol−1 |
| Dipole Moment | 4.45 ± 1.08 D |
| Volume | 341.31 Å 3 |
| Surface Area | 301.09 Å 2 |
| HOMO Energy | -8.69 ± 0.55 eV |
| LUMO Energy | 2.59 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | MBLREHINSXJTTD-ZMHPAJMFSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O Cl |