4-[3-(Tert-Butylamino)-2-Hydroxypropoxy]-1H-Indole-2-Carboxylic Acid
Properties
| Property | Value |
|---|---|
| Formula | C16H22N2O4 |
| IUPAC Name | 4-[(2s)-3-(tert-butylamino)-2-hydroxy-propoxy]indol-1-ium-2-carboxylic acid |
| Molecular Mass | 306.357 g·mol−1 |
| Heat of Formation | -640.0 ± 16.7 kJ·mol−1 |
| Dipole Moment | 1.48 ± 1.08 D |
| Volume | 378.52 Å 3 |
| Surface Area | 318.77 Å 2 |
| HOMO Energy | -8.73 ± 0.55 eV |
| LUMO Energy | -0.78 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | XYDHEGOVFRXKOO-JTQLQIEISA-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 |