1-(2,2,2-Trifluoroethoxy)-2,2,2-trifluoroethanol

Base Information

• Chemical Name: 1-(2,2,2-Trifluoroethoxy)-2,2,2-trifluoroethanol
• CAS No.: 55605-84-0
• Molecular Formula: C4H4F6O2
• Molecular Weight: 198.065
• DSSTox Substance ID: DTXSID60465757
• Nikkaji Number: J1.384.703G
• Mol file: 55605-84-0.mol

Synonyms:1-(2,2,2-Trifluoroethoxy)-2,2,2-trifluoroethanol;2,2,2-trifluoro-1-(2,2,2-trifluoroethoxy)ethanol;55605-84-0;CF3CH(OH)OCH2CF3;DTXSID60465757

Chemical Property of 1-(2,2,2-Trifluoroethoxy)-2,2,2-trifluoroethanol

Chemical Property:

• XLogP3: 1.8
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 2
• Exact Mass: 198.01154834
• Heavy Atom Count: 12
• Complexity: 138

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C(C(F)(F)F)OC(C(F)(F)F)O

Technology Process of 1-(2,2,2-Trifluoroethoxy)-2,2,2-trifluoroethanol

There total 1 articles about 1-(2,2,2-Trifluoroethoxy)-2,2,2-trifluoroethanol 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:

2,2,2-trifluoroethanol (75-89-8) + 2,2,2-Trifluoroacetaldehyde (75-90-1) → 2,2,2-trifluoro-1,1-ethanediol (421-53-4) + trifluoroacetaldehyde 2,2,2-trifluoroethyl hemiacetal (55605-84-0)

Guidance literature:

In tetrahydrofuran-d8; 2,2,2-trifluoroethanol; at -78 ℃;

DOI:10.1021/acs.joc.9b01548

Reference yield: 60.0%

furan (110-00-9) + trifluoroacetaldehyde 2,2,2-trifluoroethyl hemiacetal (55605-84-0) → 2-(2,2,2-trifluoro-1-hydroxyethyl)furan (70783-48-1)

Guidance literature:

With toluene-4-sulfonic acid;

DOI:10.1016/S0040-4039(00)00880-7

Reference yield: 43.0%

phenylmagnesium bromide + trifluoroacetaldehyde 2,2,2-trifluoroethyl hemiacetal (55605-84-0) → 1-phenyl-2,2,2-trifluoromethylethanol (340-04-5,340-05-6)

Guidance literature:

In diethyl ether;

DOI:10.1016/S0040-4039(00)00880-7

upstream raw materials:

2,2,2-trifluoroethanol

2,2,2-Trifluoroacetaldehyde

Downstream raw materials:

2-(2,2,2-trifluoro-1-hydroxyethyl)furan

1-phenyl-2,2,2-trifluoromethylethanol

2,2,2-trifluoro-1-(4-hydroxyphenyl)ethyl alcohol

2,2,2-trifluoro-1-(2-hydroxyphenyl)ethanol