1-Methylsulfonylsulfanyloctane

Base Information

• Chemical Name: 1-Methylsulfonylsulfanyloctane
• CAS No.: 7559-45-7
• Molecular Formula: C₉H₂₀O₂S₂
• Molecular Weight: 224.389
• NSC Number: 124763
• DSSTox Substance ID: DTXSID70298634
• Wikidata: Q82040553
• Mol file: 7559-45-7.mol

Synonyms:1-methylsulfonylsulfanyloctane;NSC124763;SCHEMBL5480651;DTXSID70298634;NSC-124763;FT-0673238

Chemical Property of 1-Methylsulfonylsulfanyloctane

Chemical Property:

• Vapor Pressure: 8.8E-05mmHg at 25°C
• Boiling Point: 350.6°Cat760mmHg
• Flash Point: 165.8°C
• PSA: 67.82000
• Density: 1.057g/cm³
• LogP: 4.12050
• Storage Temp.: Hygroscopic, Refrigerator, Under Inert Atmosphere
• XLogP3: 3.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 8
• Exact Mass: 224.09047222
• Heavy Atom Count: 13
• Complexity: 192

Purity/Quality:

97% ^*data from raw suppliers

OctylMethanethiosulfonate ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCCCSS(=O)(=O)C
• Uses: Reacts specifically and rapidly with thiols to form mixed disulfides, Octyl Methanethiosulfonate can be used to probe the structures of the ACh receptor channel of the GABA receptor channel and of lactose permease. Reacts specifically and rapidly with thiols to form mixed disulfides. Used to probe the structures of the ACh receptor channel of the GABA receptor channel and of lactose permease.

Technology Process of 1-Methylsulfonylsulfanyloctane

There total 1 articles about 1-Methylsulfonylsulfanyloctane which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield:

1-bromo-octane (111-83-1) + potassium methanethiosulphonate (6340-98-3) → n-octyl methanethiosulfonate (7559-45-7)

Guidance literature:

In water; acetone; Heating;

DOI:10.1021/jm00335a028

upstream raw materials:

1-bromo-octane

potassium methanethiosulphonate

Refernces