(3R,4S)-6,8-Dihydroxy-3,4,5-Trimethyl-3,4-Dihydro-1H-Isochromene-7-Carboxylic Acid
Properties
| Property | Value |
|---|---|
| Formula | C13H16O5 |
| IUPAC Name | (3r,4r)-6,8-dihydroxy-3,4,5-trimethyl-isochromane-7-carboxylic acid |
| Molecular Mass | 252.263 g·mol−1 |
| Heat of Formation | -917.6 ± 16.7 kJ·mol−1 |
| Dipole Moment | 1.31 ± 1.08 D |
| Volume | 289.76 Å 3 |
| Surface Area | 257.87 Å 2 |
| HOMO Energy | -8.96 ± 0.55 eV |
| LUMO Energy | -0.44 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | OHTHCLNOXXLROK-CAHLUQPWSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O |