As6
Properties
| Property | Value |
|---|---|
| Formula | C21H32O4S |
| IUPAC Name | (2z,4e)-5-[(1s)-3-hexylsulfanyl-1-hydroxy-2,6,6-trimethyl-4-oxo-cyclohex-2-en-1-yl]-3-methyl-penta-2,4-dienoic acid |
| Molecular Mass | 380.541 g·mol−1 |
| Heat of Formation | -825.9 ± 16.7 kJ·mol−1 |
| Dipole Moment | 4.68 ± 1.08 D |
| Volume | 486.83 Å 3 |
| Surface Area | 411.72 Å 2 |
| HOMO Energy | -8.11 ± 0.55 eV |
| LUMO Energy | -0.87 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | AOFXVHRNNSAVEA-IHZHKDPYSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C S O |