1,4-Bis(propylthio)butane

Base Information

• Chemical Name: 1,4-Bis(propylthio)butane
• CAS No.: 56348-39-1
• Molecular Formula: C10H22S2
• Molecular Weight: 206.41
• NSC Number: 163282
• UNII: FKR77BK83A
• DSSTox Substance ID: DTXSID0021701
• Wikidata: Q81983861
• Mol file: 56348-39-1.mol

Synonyms:4,9-dithiadodecane;1,4-bis(propylthio)butane;1,4-bis(propylsulfanyl)butane;56348-39-1;1,4-Bis-propylsulfanyl-butane;NSC-163282;FKR77BK83A;Butane, 1,4-bis(propylthio)-;NSC163282;UNII-FKR77BK83A;DTXSID0021701;Butane, 1,4-bis(propylthio)-?;AKOS024332230

Chemical Property of 1,4-Bis(propylthio)butane

Chemical Property:

• Vapor Pressure: 0.00593mmHg at 25°C
• Boiling Point: 281.8°Cat760mmHg
• Flash Point: 113.7°C
• PSA: 50.60000
• Density: 0.931g/cm³
• LogP: 4.05300
• XLogP3: 4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 9
• Exact Mass: 206.11629305
• Heavy Atom Count: 12
• Complexity: 64.2

Purity/Quality:

99%min ^*data from raw suppliers

4,9-Dithiadodecane ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCSCCCCSCCC

Technology Process of 1,4-Bis(propylthio)butane

There total 1 articles about 1,4-Bis(propylthio)butane 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: 41.0%

1-thiopropane (107-03-9) + 1,4-dichlorobutane (110-56-5) → propyl 4-chlorobutyl sulfide (107961-60-4) + 1,4-bis-propylsulfanyl-butane (56348-39-1)

Guidance literature:

With sodium ethanolate; In ethanol; for 12h; Yields of byproduct given; Ambient temperature;

DOI:10.1055/s-1987-28097

upstream raw materials:

1-thiopropane

1,4-dichlorobutane

Refernces