2-[4-(3,4-Dimethoxyphenyl)Butyl]Aminoethanethiol Sulfate
[CAS# 21224-62-4]

Identification

• Name: 2-[4-(3,4-Dimethoxyphenyl)Butyl]Aminoethanethiol Sulfate
• Synonyms: 1,2-Dimethoxy-4-[4-[2-(Sulfothio)Ethylamino]Butyl]Benzene; 2-((4-(3,4-Dimethoxyphenyl)Butyl)Amino)Ethanethiol Hydrogen Sulfate (Ester); Ethanethiol, 2-(4-(3,4-Dimethoxyphenyl)Butyl)Amino-, Hydrogen Sulfate (Ester)
• Molecular Formula: C₁₄H₂₃NO₅S₂
• Molecular Weight: 349.46
• CAS Registry Number: 21224-62-4
• SMILES: C1=C(C(=CC=C1CCCCNCCS[S](=O)(=O)O)OC)OC
• InChI: 1S/C14H23NO5S2/c1-19-13-7-6-12(11-14(13)20-2)5-3-4-8-15-9-10-21-22(16,17)18/h6-7,11,15H,3-5,8-10H2,1-2H3,(H,16,17,18)
• InChIKey: XPECYTOPDCVNQL-UHFFFAOYSA-N

Properties

• Density: 1.259g/cm³ (Cal.)