2-[1-(Benzyloxy)-2-Propanyl]-3-Methyl-6-Oxo-5-(2-Oxopropyl)Tetrahydro-2H-Pyran-4-Yl 3,5-Dinitrobenzoate
Properties
| Property | Value |
|---|---|
| Formula | C26H28N2O10 |
| IUPAC Name | [(2s,3s,4r,5r)-5-acetonyl-2-[(1r)-2-benzyloxy-1-methyl-ethyl]-3-methyl-6-oxo-tetrahydropyran-4-yl] 3,5-dinitrobenzoate |
| Molecular Mass | 528.508 g·mol−1 |
| Heat of Formation | -946.5 ± 16.7 kJ·mol−1 |
| Dipole Moment | 3.17 ± 1.08 D |
| Volume | 603.81 Å 3 |
| Surface Area | 502.91 Å 2 |
| HOMO Energy | -9.52 ± 0.55 eV |
| LUMO Energy | 0.50 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | QFCHHSMYAFEZCK-XPSHSCSXSA-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 |