Ethanethiol, 2-(4-(p-hydroxyphenyl)butyl)amino-, hydrogen sulfate (ester)
1-hydroxy-4-[4-(2-sulfosulfanylethylamino)butyl]benzene
Also Known As: S-2-((4-(p-Hydroxyphenyl)butyl)amino)ethyl thiosulfate|2-((4-(p-Hydroxyphenyl)butyl)amino)ethanethiol hydrogen sulfate (ester)|s-(2-{[4-(4-hydroxyphenyl)butyl]amino}ethyl) hydrogen sulfurothioate|1-hydroxy-4-[4-(2-sulfosulfanylethylamino)butyl]benzene|2-[4-(p-Hydroxyphenyl)butyl]aminoethanethiol 1-sulfate|Ethanethiol, 2-(4-(p-hydroxyphenyl)butyl)amino-, hydrogen sulfate (ester)|[(2-{[4-(4-hydroxyphenyl)butyl]amino}ethyl)sulfanyl]sulfonic acid|S-2-{[4-(4-Hydroxyphenyl)butyl]amino}ethyl hydrogen sulfurothioate
| Molecular Formula | C12H19NO4S2 |
|---|---|
| Molecular Weight | 305.07556 g/mol |
| LogP | -0.8 |
| Topological Polar Surface Area | 120.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 305.07556 |
| Monoisotopic Mass | 305.07556 |
| Heavy Atoms | 19 |
| Complexity | 321.0 |
Chemical Identifiers
| CAS Number | 24159-21-5 |
|---|---|
| SMILES | C1=CC(=CC=C1CCCCNCCSS(=O)(=O)O)O |
| InChIKey | FHLUCOZHKRLUPC-UHFFFAOYSA-N |
Product Overview
Ethanethiol, 2-(4-(p-hydroxyphenyl)butyl)amino-, hydrogen sulfate (ester) (CAS 24159-21-5), with molecular formula C12H19NO4S2 and molecular weight 305.07556 g/mol. IUPAC: 1-hydroxy-4-[4-(2-sulfosulfanylethylamino)butyl]benzene.