2-[5-(Phenylthio)Pentyl]Aminoethanethiol Sulfate
[CAS# 21224-79-3]

Identification

• Name: 2-[5-(Phenylthio)Pentyl]Aminoethanethiol Sulfate
• Synonyms: [5-[2-(Sulfothio)Ethylamino]Pentylthio]Benzene; 2-((5-(Phenylthio)Pentyl)Amino)Ethanethiol Hydrogen Sulfate (Ester); Ethanethiol, 2-(5-(Phenylthio)Pentyl)Amino-, Hydrogen Sulfate (Ester)
• Molecular Formula: C₁₃H₂₁NO₃S₃
• Molecular Weight: 335.49
• CAS Registry Number: 21224-79-3
• SMILES: C1=CC=CC=C1SCCCCCNCCS[S](=O)(=O)O
• InChI: 1S/C13H21NO3S3/c15-20(16,17)19-12-10-14-9-5-2-6-11-18-13-7-3-1-4-8-13/h1,3-4,7-8,14H,2,5-6,9-12H2,(H,15,16,17)
• InChIKey: NCIBCGFOVIJCAD-UHFFFAOYSA-N

Properties

• Density: 1.301g/cm³ (Cal.)