3-(3-Hydroxy-Benzoyloxy)-8-Methyl-8-Aza-Bicyclo[3.2.1]Octane-2-Carboxylic Acid
Properties
| Property | Value |
|---|---|
| Formula | C16H19NO5 |
| IUPAC Name | (1r,3r,4r,5s,8r)-3-(3-hydroxybenzoyl)oxy-8-methyl-8-azabicyclo[3.2.1]octane-4-carboxylic acid |
| Molecular Mass | 305.326 g·mol−1 |
| Heat of Formation | -829.5 ± 16.7 kJ·mol−1 |
| Dipole Moment | 2.39 ± 1.08 D |
| Volume | 357.96 Å 3 |
| Surface Area | 310.46 Å 2 |
| HOMO Energy | -9.38 ± 0.55 eV |
| LUMO Energy | -0.68 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | XCJJCRPRQYXLRE-YXCITZCRSA-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 |