1,1,1,2,2,3,3,4,4,5,5,6,6-Tridecafluorododecane

Base Information

• Chemical Name: 1,1,1,2,2,3,3,4,4,5,5,6,6-Tridecafluorododecane
• CAS No.: 69125-80-0
• Molecular Formula: C₁₂H₁₃F₁₃
• Molecular Weight: 404.214
• DSSTox Substance ID: DTXSID10895207
• Nikkaji Number: J1.554.064H
• Wikidata: Q82871381

Synonyms:1,1,1,2,2,3,3,4,4,5,5,6,6-Tridecafluorododecane;69125-80-0;1-(Perfluorohexyl)hexane;1-Hexylperfluorohexane;1-(Tridecafluorohexyl)hexane;SCHEMBL1768650;NIOSH/JR3165000;DTXSID10895207;LS-63490;JR31650000;Dodecane, 1,1,1,2,2,3,3,4,4,5,5,6,6-tridecafluoro-

Chemical Property of 1,1,1,2,2,3,3,4,4,5,5,6,6-Tridecafluorododecane

Chemical Property:

• Vapor Pressure: 0.241mmHg at 25°C
• XLogP3: 7.6
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 13
• Rotatable Bond Count: 9
• Exact Mass: 404.0809665
• Heavy Atom Count: 25
• Complexity: 435

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CCCCCCC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F

Technology Process of 1,1,1,2,2,3,3,4,4,5,5,6,6-Tridecafluorododecane

There total 5 articles about 1,1,1,2,2,3,3,4,4,5,5,6,6-Tridecafluorododecane 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: 81.0%

1-hexene (592-41-6,25067-06-5) + 1-bromo-1,1,2,2,3,3,4,4,5,5,6,6,6-tridecafluorohexane (335-56-8) → 1-(n-perfluorohexyl)-hexane (69125-80-0)

Guidance literature:

With tris-(trimethylsilyl)silane; 1,1'-azobis(1-cyanocyclohexanenitrile); In water; at 70 ℃; Inert atmosphere;

DOI:10.1021/jo100901z

Reference yield: 72.0%

1-hexene (592-41-6,25067-06-5) + perfluoro-n-hexyl chloride (355-41-9) → 1-(n-perfluorohexyl)-hexane (69125-80-0)

Guidance literature:

With triphenylphosphine; nickel dichloride; zinc; In N,N-dimethyl-formamide; at 95 ℃; for 8h;

DOI:10.1021/jo010178j

Reference yield: 65.0%

1-hexene (592-41-6,25067-06-5) + n-perfluorohexyl iodide (355-43-1) → 1-(n-perfluorohexyl)-hexane (69125-80-0)

Guidance literature:

With tris-(trimethylsilyl)silane; oxygen; In water; at 20 ℃; for 36h; Inert atmosphere;

DOI:10.1021/jo100901z

upstream raw materials:

1,1,1,2,2,3,3,4,4,5,5,6,6-tridecafluoro-8-iodododecane

1-hexene

perfluoro-n-hexyl chloride

1-bromo-1,1,2,2,3,3,4,4,5,5,6,6,6-tridecafluorohexane

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