4-(1-Hydroxy-2-{[3-(Phenylsulfanyl)Propyl]Amino}Propyl)Phenol
Properties
| Property | Value |
|---|---|
| Formula | C18H23NO2S |
| IUPAC Name | 4-[(1r,2r)-1-hydroxy-2-(3-phenylsulfanylpropylamino)propyl]phenol |
| Molecular Mass | 317.446 g·mol−1 |
| Heat of Formation | -238.9 ± 16.7 kJ·mol−1 |
| Dipole Moment | 3.06 ± 1.08 D |
| Volume | 399.74 Å 3 |
| Surface Area | 358.97 Å 2 |
| HOMO Energy | -8.47 ± 0.55 eV |
| LUMO Energy | -0.22 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | KNPDZXNZIJNVNH-KDOFPFPSSA-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 |