[3-[[2-(Hydroxymethyl)-7-Oxo-3,6-Dihydroinden-4-Yl]Oxy]Phenyl] 4,4,4-Trifluorobutane-1-Sulfonate
Properties
| Property | Value |
|---|---|
| Formula | C20H19F3O6S |
| IUPAC Name | [3-[[2-(hydroxymethyl)-7-oxo-3,6-dihydroinden-4-yl]oxy]phenyl] 4,4,4-trifluorobutane-1-sulfonate |
| Molecular Mass | 444.421 g·mol−1 |
| Heat of Formation | -1463.5 ± 16.7 kJ·mol−1 |
| Dipole Moment | 6.28 ± 1.08 D |
| Volume | 469.29 Å 3 |
| Surface Area | 391.95 Å 2 |
| HOMO Energy | -8.87 ± 0.55 eV |
| LUMO Energy | -1.23 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | JUASSADEMLGBMK-UHFFFAOYSA-N |
| QR Code | Generate QR Code |
| Links | PubChem |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H S C O F |