(1R,2S,4S,5R)-1,4,5-Trihydroxy-3-Oxo-2-(Pentafluorobenzyl)Cyclohexanecarboxylic Acid
Properties
| Property | Value |
|---|---|
| Formula | C14H11F5O6 |
| IUPAC Name | (1r,2s,4s,5r)-1,4,5-trihydroxy-3-oxo-2-[(2,3,4,5,6-pentafluorophenyl)methyl]cyclohexanecarboxylic acid |
| Molecular Mass | 370.226 g·mol−1 |
| Heat of Formation | -1949.4 ± 16.7 kJ·mol−1 |
| Dipole Moment | 3.91 ± 1.08 D |
| Volume | 359.35 Å 3 |
| Surface Area | 299.19 Å 2 |
| HOMO Energy | -10.64 ± 0.55 eV |
| LUMO Energy | 1.60 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | ZNZHQTVBMHBUCF-GLOYCNQYSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O F |