13,13,14,14,15,15,16,16,17,17,18,18,18-Tridecafluoro-1-phenyl-2,5,8,11-tetraoxaoctadecane

Base Information

• Chemical Name: 13,13,14,14,15,15,16,16,17,17,18,18,18-Tridecafluoro-1-phenyl-2,5,8,11-tetraoxaoctadecane
• CAS No.: 129086-12-0
• Molecular Formula: C₂₀H₂₁F₁₃O₄
• Molecular Weight: 572.364
• DSSTox Substance ID: DTXSID601123079
• Mol file: 129086-12-0.mol

Synonyms:DTXSID601123079;129086-12-0;13,13,14,14,15,15,16,16,17,17,18,18,18-Tridecafluoro-1-phenyl-2,5,8,11-tetraoxaoctadecane

Chemical Property of 13,13,14,14,15,15,16,16,17,17,18,18,18-Tridecafluoro-1-phenyl-2,5,8,11-tetraoxaoctadecane

Chemical Property:

• XLogP3: 5.6
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 17
• Rotatable Bond Count: 17
• Exact Mass: 572.1232253
• Heavy Atom Count: 37
• Complexity: 665

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C1=CC=C(C=C1)COCCOCCOCCOCC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F

Technology Process of 13,13,14,14,15,15,16,16,17,17,18,18,18-Tridecafluoro-1-phenyl-2,5,8,11-tetraoxaoctadecane

There total 6 articles about 13,13,14,14,15,15,16,16,17,17,18,18,18-Tridecafluoro-1-phenyl-2,5,8,11-tetraoxaoctadecane 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:

triethylene glycol monobenzyl ether (55489-58-2,1201808-31-2) → (2-{2-[2-(2,2,3,3,4,4,5,5,6,6,7,7,7-Tridecafluoro-heptyloxy)-ethoxy]-ethoxy}-ethoxymethyl)-benzene (129086-12-0)

Guidance literature:

Multi-step reaction with 2 steps

1: 88 percent / SOCl₂ / 18 h / 80 °C

2: dioxane / Heating

With thionyl chloride; In 1,4-dioxane;

Reference yield:

2,2'-[1,2-ethanediylbis(oxy)]bisethanol (112-27-6) → (2-{2-[2-(2,2,3,3,4,4,5,5,6,6,7,7,7-Tridecafluoro-heptyloxy)-ethoxy]-ethoxy}-ethoxymethyl)-benzene (129086-12-0)

Guidance literature:

Multi-step reaction with 3 steps

1: 65 percent / 50percent NaOH / H₂O / 24 h / Heating

2: 88 percent / SOCl₂ / 18 h / 80 °C

3: dioxane / Heating

With sodium hydroxide; thionyl chloride; In 1,4-dioxane; water;

Reference yield:

benzyl chloride (100-44-7) → (2-{2-[2-(2,2,3,3,4,4,5,5,6,6,7,7,7-Tridecafluoro-heptyloxy)-ethoxy]-ethoxy}-ethoxymethyl)-benzene (129086-12-0)

Guidance literature:

Multi-step reaction with 3 steps

1: 50percent aq. soda / 24 h / Heating

2: pyridine / 4 h / Ambient temperature

3: potassium hydroxide / dioxane / 48 h / Heating

With potassium hydroxide; sodium carbonate; In 1,4-dioxane; pyridine;

upstream raw materials:

2,2,3,3,4,4,5,5,6,6,7,7,7-tridecafluoroheptan-1-ol

triethylene glycol monobenzyl tosyl ether

1-chloro-10-phenyl-3,6,9-trioxadecane

triethylene glycol monobenzyl ether