2-[4-(4-Methoxyphenoxy)Butyl]Aminoethanethiol Sulfate
[CAS# 21224-86-2]

Identification

• Name: 2-[4-(4-Methoxyphenoxy)Butyl]Aminoethanethiol Sulfate
• Synonyms: 1-Methoxy-4-[4-[2-(Sulfothio)Ethylamino]Butoxy]Benzene; S-2-((4-(P-Methoxyphenyloxy)Butyl)Amino)Ethyl Thiosulfate; 2-((4-(P-Methoxyphenoxy)Butyl)Amino)Ethanethiol Hydrogen Sulfate (Ester)
• Molecular Formula: C₁₃H₂₁NO₅S₂
• Molecular Weight: 335.43
• CAS Registry Number: 21224-86-2
• SMILES: C1=CC(=CC=C1OCCCCNCCS[S](=O)(=O)O)OC
• InChI: 1S/C13H21NO5S2/c1-18-12-4-6-13(7-5-12)19-10-3-2-8-14-9-11-20-21(15,16)17/h4-7,14H,2-3,8-11H2,1H3,(H,15,16,17)
• InChIKey: ITIHKDXKSDQGGZ-UHFFFAOYSA-N

Properties

• Density: 1.284g/cm³ (Cal.)