3-(1,3-Dimethyl-2,6-Dioxo-1,2,3,6-Tetrahydro-7H-Purin-7-Yl)-2-Hydroxypropyl 2,4-Dichlorobenzoate
Properties
| Property | Value |
|---|---|
| Formula | C17H16Cl2N4O5 |
| IUPAC Name | [(2s)-3-(1,3-dimethyl-2,6-dioxo-purin-7-yl)-2-hydroxy-propyl] 2,4-dichlorobenzoate |
| Molecular Mass | 427.239 g·mol−1 |
| Heat of Formation | 1184.4 ± 16.7 kJ·mol−1 |
| Dipole Moment | 5.30 ± 1.08 D |
| Volume | 450.8 Å 3 |
| Surface Area | 350.92 Å 2 |
| HOMO Energy | -8.64 ± 0.55 eV |
| LUMO Energy | -2.11 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | KYTFTNAVIDOEID-JTQLQIEISA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | C N O Cl |