5-Allyl-5-(5-Hydroxy-3-Hexyn-2-Yl)-1-Methyl-2,4,6(1H,3H,5H)-Pyrimidinetrione
Properties
| Property | Value |
|---|---|
| Formula | C14H18N2O4 |
| IUPAC Name | (5s)-5-allyl-5-[(1r,4s)-4-hydroxy-1-methyl-pent-2-ynyl]-1-methyl-hexahydropyrimidine-2,4,6-trione |
| Molecular Mass | 278.304 g·mol−1 |
| Heat of Formation | -508.3 ± 16.7 kJ·mol−1 |
| Dipole Moment | 1.31 ± 1.08 D |
| Volume | 340.07 Å 3 |
| Surface Area | 298.58 Å 2 |
| HOMO Energy | -10.46 ± 0.55 eV |
| LUMO Energy | -0.43 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | MTMBJMKMFXBBIP-BFVZDQMLSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O N |