2-(4-(4-Methoxyphenyl)Butyl)Amino-Ethanethiol Hydrogen Thiosulfate
[CAS# 21208-80-0]

Identification

• Name: 2-(4-(4-Methoxyphenyl)Butyl)Amino-Ethanethiol Hydrogen Thiosulfate
• Synonyms: 1-Methoxy-4-[4-[2-(Sulfothio)Ethylamino]Butyl]Benzene; Ethanethiol, 2-(4-(P-Methoxyphenyl)Butyl)Amino-, Hydrogen Thiosulfate; S-2-((4-(P-Methoxyphenyl)Butyl)Amino)Ethyl Hydrogen Thiosulfate
• Molecular Formula: C₁₃H₂₁NO₄S₂
• Molecular Weight: 319.43
• CAS Registry Number: 21208-80-0
• SMILES: C1=C(C=CC(=C1)CCCCNCCS[S](=O)(=O)O)OC
• InChI: 1S/C13H21NO4S2/c1-18-13-7-5-12(6-8-13)4-2-3-9-14-10-11-19-20(15,16)17/h5-8,14H,2-4,9-11H2,1H3,(H,15,16,17)
• InChIKey: GVAQGXFHYGHMRN-UHFFFAOYSA-N

Properties

• Density: 1.26g/cm³ (Cal.)