Ethanethiol, 2-((5-(cyclohexyloxy)pentyl)amino)-, hydrogen sulfate (ester)
5-(2-sulfosulfanylethylamino)pentoxycyclohexane
Also Known As: S-2-(((5-Cyclohexyloxy)pentyl)amino)ethyl thiosulfate|5-(2-sulfosulfanylethylamino)pentoxycyclohexane|2-[[5-(cyclohexyloxy)pentyl]amino]ethanethiol sulfate|2-(((5-Cyclohexyloxy)pentyl)amino)ethanethiol hydrogen sulfate (ester)|s-(2-{[5-(cyclohexyloxy)pentyl]amino}ethyl) hydrogen sulfurothioate|Thiosulfuric acid, S-(2-((5-(cyclohexyloxy)pentyl)amino)ethyl) ester|Ethanethiol, 2-((5-(cyclohexyloxy)pentyl)amino)-, hydrogen sulfate (ester)|[(2-{[5-(cyclohexyloxy)pentyl]amino}ethyl)sulfanyl]sulfonic acid
| Molecular Formula | C13H27NO4S2 |
|---|---|
| Molecular Weight | 325.13815 g/mol |
| LogP | -0.4 |
| Topological Polar Surface Area | 109.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 11 |
| Exact Mass | 325.13815 |
| Monoisotopic Mass | 325.13815 |
| Heavy Atoms | 20 |
| Complexity | 324.0 |
Chemical Identifiers
| CAS Number | 2408-79-9 |
|---|---|
| SMILES | C1CCC(CC1)OCCCCCNCCSS(=O)(=O)O |
| InChIKey | MISILYUNIIMPQU-UHFFFAOYSA-N |
Product Overview
Ethanethiol, 2-((5-(cyclohexyloxy)pentyl)amino)-, hydrogen sulfate (ester) (CAS 2408-79-9), with molecular formula C13H27NO4S2 and molecular weight 325.13815 g/mol. IUPAC: 5-(2-sulfosulfanylethylamino)pentoxycyclohexane.