Methyl 5-[Hydroxy(6-Methyl-5,6,7,8-Tetrahydro[1,3]Dioxolo[4,5-G]Isoquinolin-5-Yl)Methyl]-1,3-Benzodioxole-4-Carboxylate
Properties
| Property | Value |
|---|---|
| Formula | C21H21NO7 |
| IUPAC Name | methyl 5-[(r)-hydroxy-[(5r)-6-methyl-7,8-dihydro-5h-[1,3]dioxolo[4,5-g]isoquinolin-5-yl]methyl]-1,3-benzodioxole-4-carboxylate |
| Molecular Mass | 399.394 g·mol−1 |
| Heat of Formation | -884.4 ± 16.7 kJ·mol−1 |
| Dipole Moment | 3.95 ± 1.08 D |
| Volume | 441.08 Å 3 |
| Surface Area | 336.77 Å 2 |
| HOMO Energy | -8.62 ± 0.55 eV |
| LUMO Energy | -0.50 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | DYXUHSYICPYLBB-RTBURBONSA-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 |