Lithium;2,2,2-trifluoroacetic acid

Base Information

• Chemical Name: Lithium;2,2,2-trifluoroacetic acid
• CAS No.: 2923-17-3
• Deprecated CAS: 2020075-17-4,2830558-17-1
• Molecular Formula: C2F3LiO2
• Molecular Weight: 119.957
• Hs Code.: 29159000
• Mol file: 2923-17-3.mol

Synonyms:Acetic acid, 2,2,2-trifluoro-, lithium salt (1:1)

Chemical Property of Lithium;2,2,2-trifluoroacetic acid

Chemical Property:

• Appearance/Colour: white powder
• Vapor Pressure: 96.2mmHg at 25°C
• Melting Point: 250℃
• Boiling Point: 72.2 °C at 760 mmHg
• PSA: 40.13000
• Density: 1.743
• LogP: -0.70140
• Sensitive.: Hygroscopic
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 0
• Exact Mass: 121.00886719
• Heavy Atom Count: 8
• Complexity: 83.4

Purity/Quality:

97% ^*data from raw suppliers

Lithium trifluoroacetate 97% ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi,T
• Hazard Codes: Xi,T
• Statements: 36/37/38
• Safety Statements: 26

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: [Li+].C(=O)(C(F)(F)F)O

Technology Process of Lithium;2,2,2-trifluoroacetic acid

There total 12 articles about Lithium;2,2,2-trifluoroacetic acid 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: 94.0%

lithium iodide monohydrate + 4-(dimethylamino)phenylthallium bis(trifluroacetate) * 2CF3COOH → thallium(III) iodide (13453-37-7) + lithium trifluoroacetate (2923-17-3) + N,N-dimethyl-aniline (121-69-7,77733-26-7)

Guidance literature:

In acetone; -70°C, several hours, warming to room temp.; redn. of vol. (distn., vac., room temp.), pptn. on addn. of water, crystn. (overnight), dissolving (acetone), pptn. on pentane addn., crystn. (several days);

Reference yield: 83.0%

Li(1+)*C6F5(1-)=Li(C6F5) (1076-44-4) + (C6H5)3PCH3(1+)*CF3CO2(1-)={(C6H5)3PCH3}{CF3CO2} (89803-75-8) + silver trifluoroacetate (2966-50-9) → {Ag(C6F5)(CH2P(C6H5)3)} + Pentafluorobenzene (363-72-4) + lithium trifluoroacetate (2923-17-3)

Guidance literature:

In diethyl ether; addn. of Ag(CF3CO2) at -78°C to a soln. of Li(C6F5) in diethyl ether, stirred for 60 min under N2, addn. of (PPh3CH3)(CF3CO2), stirred for 10 min, warmed to room temp.; pptn. filtered off, washed with water, dissolved in diethyl ether, filtered through a layer of anhydrous MgSO4, evapn., addn. of n-hexane, pptn.; elem. anal.;

Reference yield: 81.0%

Li(1+)*C6F5(1-)=Li(C6F5) (1076-44-4) + {P(C6H5)2(CH3)2}(1+)*CF3CO2(1-)={P(C6H5)2(CH3)2}{CF3CO2} (117968-03-3) + silver trifluoroacetate (2966-50-9) → {Ag(C6F5)(CH2P(C6H5)2CH3)} + Pentafluorobenzene (363-72-4) + lithium trifluoroacetate (2923-17-3)

Guidance literature:

In diethyl ether; addn. of Ag(CF3CO2) to a soln. of Li(C6F5) in diethyl ether at -78°C, stirred for 60 min under N2, addn. of (P(C6H5)2(CH3)2)(CF3CO2), stirred for 10 min, warmed to room temp.; filtered, concd., addn. of n-hexane, recrystn.; elem. anal.;

upstream raw materials:

Li⁽¹⁺⁾*C₆F₅^(1-)=Li(C₆F₅)

{PC₆H₅(CH₃)3}⁽¹⁺⁾*CF₃CO₂^(1-)={PC₆H₅(CH₃)3}{CF₃CO₂}

silver trifluoroacetate

(C₆H₅)3PCH₃⁽¹⁺⁾*CF₃CO₂^(1-)={(C₆H₅)3PCH₃}{CF₃CO₂}

Downstream raw materials:

Hexafluoroacetone

2,2,2-Trifluoroacetophenone

erbium(III) oxyfluoride

lithium fluoride