2,4,6-Trihydroxy-5-{(1R)-1-[(1S,4As,6R,8As)-6-(2-Hydroxy-2-Propanyl)-8A-Methyl-4-Methylenedecahydro-1-Naphthalenyl]-3-Methylbutyl}Isophthalaldehyde
Properties
| Property | Value |
|---|---|
| Formula | C28H40O6 |
| IUPAC Name | 5-[(1r)-1-[(1s,4as,6r,8as)-6-(1-hydroxy-1-methyl-ethyl)-8a-methyl-4-methylene-decalin-1-yl]-3-methyl-butyl]-2,4,6-trihydroxy-benzene-1,3-dicarbaldehyde |
| Molecular Mass | 472.614 g·mol−1 |
| Heat of Formation | -1229.0 ± 16.7 kJ·mol−1 |
| Dipole Moment | 4.96 ± 1.08 D |
| Volume | 585.72 Å 3 |
| Surface Area | 451.97 Å 2 |
| HOMO Energy | -9.34 ± 0.55 eV |
| LUMO Energy | -1.03 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | OOAOETHJYYAVCC-SMYUTWQPSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O |