1H-2-Benzopyran-6,8(7H,8Ah)-Dione, 7-(Acetyloxy)-5-Chloro-3-(3,5-Dimethyl-1,3-Heptadienyl)-8A-Hydroxy-7-Methyl-
Properties
| Property | Value |
|---|---|
| Formula | C21H25ClO6 |
| IUPAC Name | [(7r,8as)-5-chloro-3-[(1e,3e,5s)-3,5-dimethylhepta-1,3-dienyl]-8a-hydroxy-7-methyl-6,8-dioxo-1h-isochromen-7-yl] acetate |
| Molecular Mass | 408.873 g·mol−1 |
| Heat of Formation | -956.2 ± 16.7 kJ·mol−1 |
| Dipole Moment | 5.08 ± 1.08 D |
| Volume | 478.71 Å 3 |
| Surface Area | 410.14 Å 2 |
| HOMO Energy | -8.87 ± 0.55 eV |
| LUMO Energy | -1.32 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | AJQIMDBOBJADCM-FGJPCINASA-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 |