Octadecyl sulfide

Base Information

• Chemical Name: Octadecyl sulfide
• CAS No.: 1844-09-3
• Molecular Formula: C36H74 S
• Molecular Weight: 539.05
• Hs Code.: 2930909090
• European Community (EC) Number: 217-423-3
• NSC Number: 71652
• UNII: 23B8T458US
• DSSTox Substance ID: DTXSID9062019
• Nikkaji Number: J97.261D
• Wikidata: Q27253739
• Mol file: 1844-09-3.mol

Synonyms:Octadecyl sulfide;Dioctadecyl sulfide;1844-09-3;n-octadecyl sulfide;Distearyl sulfide;1-octadecylsulfanyloctadecane;Octadecane, 1,1'-thiobis-;Dioctadecyl sulphide;UNII-23B8T458US;23B8T458US;EINECS 217-423-3;NSC 71652;NSC-71652;AI3-12176;Stearyl Sulfide;dioctadecylsulfane;dioctadecylsulfide;di-n-octadecyl sulfide;Octadecane,1'-thiobis-;1,1'-Thio-bis-octadecane;SCHEMBL482678;DTXSID9062019;C36H74S;1-(Octadecylsulfanyl)octadecane #;BAA84409;NSC71652;C36-H74-S;MFCD00026688;AKOS024399260;FT-0625204;O0148;D91818;Q27253739

Chemical Property of Octadecyl sulfide

Chemical Property:

• Vapor Pressure: 3.54E-13mmHg at 25°C
• Melting Point: 70°C
• Boiling Point: 587.7oC at 760 mmHg
• Flash Point: 356.5oC
• PSA: 25.30000
• Density: 0.846g/cm3
• LogP: 14.24260
• XLogP3: 18.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 34
• Exact Mass: 538.55112353
• Heavy Atom Count: 37
• Complexity: 332

Purity/Quality:

98%,99%, ^*data from raw suppliers

Octadecyl Sulfide >96.0%(GC) ^*data from reagent suppliers

Safty Information:

• Statements: 36/37/38
• Safety Statements: 26-36/37/39

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: CCCCCCCCCCCCCCCCCCSCCCCCCCCCCCCCCCCCC

Technology Process of Octadecyl sulfide

There total 5 articles about Octadecyl sulfide 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:

n-octadecyl p-toluenesulfonate (3386-32-1) → dioctadecyl sulfide (1844-09-3)

Guidance literature:

With water;

DOI:10.1021/ja01154a122

Reference yield:

n-octadecyl p-toluenesulfonate (3386-32-1) → dioctadecyl sulfide (1844-09-3)

Guidance literature:

With sodium sulfide; ethanol;

DOI:10.1021/jo50017a021

Reference yield:

1-Bromooctadecane (112-89-0) → dioctadecyl sulfide (1844-09-3)

Guidance literature:

With hydrogen sulfide; sodium ethanolate;

upstream raw materials:

n-octadecyl p-toluenesulfonate

1-Bromooctadecane

octadecylmercapto-succinic acid diethyl ester

Downstream raw materials:

dioctadecyl sulfoxide