(5Z)-7-{(1S,2R,3R,5S)-3-[(1E,3S)-3-Hydroxy-1-Octen-1-Yl]-6-Oxabicyclo[3.1.1]Hept-2-Yl}-5-Heptenoic Acid
Properties
| Property | Value |
|---|---|
| Formula | C21H34O4 |
| IUPAC Name | (z)-7-[(1s,2r,3r,5s)-3-[(e,3s)-3-hydroxyoct-1-enyl]-6-oxabicyclo[3.1.1]heptan-2-yl]hept-5-enoic acid |
| Molecular Mass | 350.492 g·mol−1 |
| Heat of Formation | -790.3 ± 16.7 kJ·mol−1 |
| Dipole Moment | 3.77 ± 1.08 D |
| Volume | 473.93 Å 3 |
| Surface Area | 360.39 Å 2 |
| HOMO Energy | -9.65 ± 0.55 eV |
| LUMO Energy | 3.71 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | HAJUMEFPOWPAQL-IGUVKOCZSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O |