(2S)-2-[(6-Ethoxy-1,3-Benzothiazol-2-Yl)Sulfanyl]-2-Phenylpropanoic Acid
Properties
| Property | Value |
|---|---|
| Formula | C18H17NO3S2 |
| IUPAC Name | (2s)-2-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfanyl]-2-phenyl-propanoic acid |
| Molecular Mass | 359.462 g·mol−1 |
| Heat of Formation | -272.7 ± 16.7 kJ·mol−1 |
| Dipole Moment | 5.03 ± 1.08 D |
| Volume | 404.19 Å 3 |
| Surface Area | 335.78 Å 2 |
| HOMO Energy | -8.93 ± 0.55 eV |
| LUMO Energy | -1.12 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | FREWOKWARGJVCE-SFHVURJKSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H S C O N |