2-[5-(4-Methoxyphenyl)Pentyl]Aminoethanethiol Sulfate
[CAS# 21224-61-3]

Identification

• Name: 2-[5-(4-Methoxyphenyl)Pentyl]Aminoethanethiol Sulfate
• Synonyms: 1-Methoxy-4-[5-[2-(Sulfothio)Ethylamino]Pentyl]Benzene; S-2-((5-(P-Methoxyphenyl)Pentyl)Amino)Ethyl Thiosulfate; 2-((5-(P-Methoxyphenyl)Pentyl)Amino)Ethanethiol Hydrogen Sulfate (Ester)
• Molecular Formula: C₁₄H₂₃NO₄S₂
• Molecular Weight: 333.46
• CAS Registry Number: 21224-61-3
• SMILES: C1=CC(=CC=C1CCCCCNCCS[S](=O)(=O)O)OC
• InChI: 1S/C14H23NO4S2/c1-19-14-8-6-13(7-9-14)5-3-2-4-10-15-11-12-20-21(16,17)18/h6-9,15H,2-5,10-12H2,1H3,(H,16,17,18)
• InChIKey: SIUJAKUGWXJHSR-UHFFFAOYSA-N

Properties

• Density: 1.235g/cm³ (Cal.)