4-Hydroxy-4-[3-(4-Hydroxyphenyl)Propyl]-3-Methoxy-2,5-Cyclohexadien-1-One
Properties
| Property | Value |
|---|---|
| Formula | C16H18O4 |
| IUPAC Name | (4s)-4-hydroxy-4-[3-(4-hydroxyphenyl)propyl]-3-methoxy-cyclohexa-2,5-dien-1-one |
| Molecular Mass | 274.312 g·mol−1 |
| Heat of Formation | -519.5 ± 16.7 kJ·mol−1 |
| Dipole Moment | 4.26 ± 1.08 D |
| Volume | 335.77 Å 3 |
| Surface Area | 303.4 Å 2 |
| HOMO Energy | -9.07 ± 0.55 eV |
| LUMO Energy | -0.68 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | NJYVKQKWDWFJQQ-INIZCTEOSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O |