Allyl(6-(3-(4-Bromophenyl)Benzo(D)Isothiazol-6-Yloxy)Hexyl)Methylamine
Properties
| Property | Value |
|---|---|
| Formula | C23H27BrN2OS |
| IUPAC Name | n-allyl-6-[[3-(4-bromophenyl)-1,2-benzothiazol-6-yl]oxy]-n-methyl-hexan-1-amine |
| Molecular Mass | 459.442 g·mol−1 |
| Heat of Formation | 153.4 ± 16.7 kJ·mol−1 |
| Dipole Moment | 5.63 ± 1.08 D |
| Volume | 519.61 Å 3 |
| Surface Area | 471.25 Å 2 |
| HOMO Energy | -8.66 ± 0.55 eV |
| LUMO Energy | 2.22 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | UCIDPJLYUKNYFZ-UHFFFAOYSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | C H O N S Br |