Tris(2,2,2-trifluoroethyl)orthoformate

Base Information

• Chemical Name: Tris(2,2,2-trifluoroethyl)orthoformate
• CAS No.: 58244-27-2
• Molecular Formula: C7H7F9O3
• Molecular Weight: 310.116
• Hs Code.: 2909199090
• European Community (EC) Number: 674-864-8
• DSSTox Substance ID: DTXSID30395037
• Wikidata: Q81985917
• Mol file: 58244-27-2.mol

Synonyms:Tris(2,2,2-trifluoroethyl)orthoformate;58244-27-2;TRIS[(TRIFLUOROETHOXY)METHANE];2-[bis(2,2,2-trifluoroethoxy)methoxy]-1,1,1-trifluoroethane;tris(Trifluoroethoxy)methane;tris(2,2,2-trifluoroethoxy)methane;C7H7F9O3;SCHEMBL20746309;DTXSID30395037;IESBVSNCDNHMSL-UHFFFAOYSA-N;MFCD04973415;AKOS025310044;AS-47846;FT-0677159;F16353

Chemical Property of Tris(2,2,2-trifluoroethyl)orthoformate

Chemical Property:

• Refractive Index: 1.31
• Boiling Point: 164.7°Cat760mmHg
• Flash Point: 59.5°C
• PSA: 27.69000
• Density: 1.457g/cm³
• LogP: 3.00670
• Storage Temp.: Hygroscopic, Refrigerator, under inert atmosphere
• Solubility.: Chloroform (Slightly), Methanol (Slightly)
• XLogP3: 3.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 12
• Rotatable Bond Count: 6
• Exact Mass: 310.02514754
• Heavy Atom Count: 19
• Complexity: 213

Purity/Quality:

≥99.0% ^*data from raw suppliers

Tris(2,2,2-trifluoroethyl)orthoformate ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xi

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C(C(F)(F)F)OC(OCC(F)(F)F)OCC(F)(F)F
• Uses: Tris(2,2,2-trifluoroethyl)orthoformate has high concentration electrolyte behavior near lithium metal anode surface which is used in lithium metal batteries.

Technology Process of Tris(2,2,2-trifluoroethyl)orthoformate

There total 4 articles about Tris(2,2,2-trifluoroethyl)orthoformate 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:

chloroform (67-66-3,8013-54-5) + 2,2,2-trifluoroethanol (75-89-8) → tris(2,2,2-trifluoroethyl)orthoformate (58244-27-2)

Guidance literature:

With iron(III) chloride;

DOI:10.1021/jo00398a019

Reference yield:

2,2,2-trifluoroethanol (75-89-8) + trifluoroethoxyfluorodiazirine (154914-84-8) → tris(2,2,2-trifluoroethyl)orthoformate (58244-27-2)

Guidance literature:

Irradiation;

DOI:10.1016/S0040-4039(00)60396-9

Reference yield:

2,2,2-trifluoroethanol (75-89-8) + bis-trifluoroethoxydiazirine (154914-85-9) → tris(2,2,2-trifluoroethyl)orthoformate (58244-27-2)

Guidance literature:

Yield given; Ambient temperature;

DOI:10.1016/S0040-4039(00)60396-9

upstream raw materials:

chloroform

2,2,2-trifluoroethanol

trifluoroethoxyfluorodiazirine

bis-trifluoroethoxydiazirine

Downstream raw materials:

1-[1,1-Bis-(2,2,2-trifluoro-ethoxy)-ethyl]-4-nitro-benzene

Refernces