Thiosulfuric Acid Hydrogen S-[2-[(6-Phenylhexyl)Amino]Ethyl] Ester
[CAS 27976-22-3]

Identification

• Name: Thiosulfuric Acid Hydrogen S-[2-[(6-Phenylhexyl)Amino]Ethyl] Ester
• Synonyms: 6-[2-(Sulfothio)Ethylamino]Hexylbenzene; Brn 2869942; Ethanethiol, 2-(6-Phenylhexyl)Amino-, Hydrogen Sulfate (Ester)
• Molecular Formula: C₁₄H₂₃NO₃S₂
• Molecular Weight: 317.46
• CAS Registry Number: 27976-22-3
• SMILES: C1=C(CCCCCCNCCS[S](=O)(=O)O)C=CC=C1
• InChI: 1S/C14H23NO3S2/c16-20(17,18)19-13-12-15-11-7-2-1-4-8-14-9-5-3-6-10-14/h3,5-6,9-10,15H,1-2,4,7-8,11-13H2,(H,16,17,18)
• InChIKey: CHDCOQRRIRGECX-UHFFFAOYSA-N

Properties

• Density: 1.209g/cm³ (Cal.)