5-[(1R)-1-{(1R,2R)-2-[(1R,3R)-2,2-Dimethyl-3-(3-Oxobutyl)Cyclopropyl]-1-Methyl-3-Oxocyclopentyl}-3-Methylbutyl]-2,4,6-Trihydroxyisophthalaldehyde
Properties
| Property | Value |
|---|---|
| Formula | C28H38O7 |
| IUPAC Name | 5-[(1r)-1-[(1r,2r)-2-[(1r,3r)-2,2-dimethyl-3-(3-oxobutyl)cyclopropyl]-1-methyl-3-oxo-cyclopentyl]-3-methyl-butyl]-2,4,6-trihydroxy-benzene-1,3-dicarbaldehyde |
| Molecular Mass | 486.597 g·mol−1 |
| Heat of Formation | -1329.8 ± 16.7 kJ·mol−1 |
| Dipole Moment | 5.25 ± 1.08 D |
| Volume | 596.47 Å 3 |
| Surface Area | 453.99 Å 2 |
| HOMO Energy | -9.44 ± 0.55 eV |
| LUMO Energy | -1.08 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | KGPNGYABEKLGJP-IGTSPWJPSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O |