1-O-[2-(4-Chlorophenoxy)-2-Methylpropanoyl]-D-Glucofuranuronic Acid
Properties
| Property | Value |
|---|---|
| Formula | C16H19ClO9 |
| IUPAC Name | (2s)-2-[(2s,3r,4r,5s)-5-[2-(4-chlorophenoxy)-2-methyl-propanoyl]oxy-3,4-dihydroxy-tetrahydrofuran-2-yl]-2-hydroxy-acetic acid |
| Molecular Mass | 390.770 g·mol−1 |
| Heat of Formation | -1610.1 ± 16.7 kJ·mol−1 |
| Dipole Moment | 3.25 ± 1.08 D |
| Volume | 414.7 Å 3 |
| Surface Area | 315.41 Å 2 |
| HOMO Energy | -9.62 ± 0.55 eV |
| LUMO Energy | -0.37 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | SQRMJHLEXPNYKB-JLDUMIBSSA-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 |