2,3-Dihydro-1,4-Benzodioxin-2-Ylmethyl [4-Hydroxy-3,5-Bis(1-Pyrrolidinylmethyl)Phenyl]Acetate
Properties
| Property | Value |
|---|---|
| Formula | C27H34N2O5 |
| IUPAC Name | [(3r)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl 2-[4-hydroxy-3,5-bis(pyrrolidin-1-ylmethyl)phenyl]acetate |
| Molecular Mass | 466.569 g·mol−1 |
| Heat of Formation | -728.4 ± 16.7 kJ·mol−1 |
| Dipole Moment | 5.16 ± 1.08 D |
| Volume | 579.47 Å 3 |
| Surface Area | 460.05 Å 2 |
| HOMO Energy | -8.71 ± 0.55 eV |
| LUMO Energy | -0.12 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | HLQWZRORUBOPJF-HSZRJFAPSA-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 |