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33454-82-9

Basic Information
CAS No.: 33454-82-9
Name: Lithium triflate
Article Data: 10
Molecular Structure:
Molecular Structure of 33454-82-9 (Lithium triflate)
Formula: CHF3LiO3S
Molecular Weight: 156.011
Synonyms: Methanesulfonicacid, trifluoro-, lithium salt (8CI,9CI);AQ 75T;Fluorad FC 122;LiTFS;Lithium triflate;Lithium trifluoromethanesulfonate;Lithiumtrifluoromethanesulfonate (LiSO3CF3);Lithium trifluoromethylsulfonate;PFM-Li;Sankonol AQ 50T;Sankonol AQ 75T;Sankonol EAc 30T;Trifluoromethanesulfonicacid lithium salt;
EINECS: 251-528-5
Density: 1,9 g/cm3
Melting Point: >300 °C(lit.)
Boiling Point: 162 °C at 760 mmHg
Solubility: soluble in water
Appearance: white powder
Hazard Symbols: IrritantXi
Risk Codes: 36/37/38
Safety: 26-36-37/39
PSA: 65.58000
LogP: 1.13220
Synthetic route
1493-13-6

trifluorormethanesulfonic acid

lithium chloride

33454-82-9

lithium trifluoromethanesulfonate

Conditions
ConditionsYield
In water at 100℃; for 1h;93.3%
4167-85-5

LiSn(C6H5)2CH3

135580-50-6

{(CH3)3C}{(CH3)2CH}Si(OSO2CF3)2

1493-13-6

trifluorormethanesulfonic acid

124-40-3

dimethyl amine

A

135580-44-8

{(CH3)3C}{(CH3)2CH}{(CH3)2N}SiSn{N(CH3)2}(C6H5)CH3

B

33454-82-9

lithium trifluoromethanesulfonate

C

79430-76-5

[Me2NH2]OTf

Conditions
ConditionsYield
In diethyl ether; toluene byproducts: C6H6; Ar-atmosphere; addn. of LiSnPh2Me to Si-derivative in ether (-&0°C), toluene addn., addn. of triflic acid (-70°C), stirring (3 h, -70°C), addn. of Me2NH (-40°C); sepn. of Me2NH2OSO2CF3, filtration, evapn. (vac.), fractional distn.; mixt. of stereoisomers (1 : 1) not sepd.; elem. anal.;A 54%
B n/a
C n/a
2794-60-7

barium trifluoromethanesulfonate

33454-82-9

lithium trifluoromethanesulfonate

Conditions
ConditionsYield
With lithium sulfate In water for 24h;
72971-96-1

bis(trifluoromethyl)sulfone

33454-82-9

lithium trifluoromethanesulfonate

Conditions
ConditionsYield
With lithium hydroxide In methanol at 0℃; for 0.5h;
2794-60-7

barium trifluoromethanesulfonate

1310-65-2

lithium hydroxide

33454-82-9

lithium trifluoromethanesulfonate

Conditions
ConditionsYield
With sulfuric acid In water
With dild. H2SO4 In water
1493-13-6

trifluorormethanesulfonic acid

1310-65-2

lithium hydroxide

33454-82-9

lithium trifluoromethanesulfonate

Conditions
ConditionsYield
byproducts: H2O;
335-05-7

Trifluoromethanesulfonyl fluoride

1310-65-2

lithium hydroxide

33454-82-9

lithium trifluoromethanesulfonate

Conditions
ConditionsYield
byproducts: HF;
675825-21-5

Lithium enolate of the acetaldehyde

34946-82-2

copper(II) bis(trifluoromethanesulfonate)

33454-82-9

lithium trifluoromethanesulfonate

34946-82-2

copper(II) bis(trifluoromethanesulfonate)

27557-78-4

1,2,2-triphenyl-ethanone; lithium enolate

33454-82-9

lithium trifluoromethanesulfonate

(C6H5)2Sn(OSO2CF3)2
27607-86-9

(C6H5)2Sn(OSO2CF3)2

4039-32-1

lithium hexamethyldisilazane

A

135580-43-7

(C6H5)2Sn{N(Si(CH3)3)2}(OSO2CF3)

B

33454-82-9

lithium trifluoromethanesulfonate

Conditions
ConditionsYield
In diethyl ether Ar-atmosphere; mixing at -50°C, warming to room temp. (during 2 h); evapn. (vac., room temp.), toluene addn. filtration off of Li-triflate, evapn. (vac.); elem. anal.;A >95
B n/a
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Specification

This chemical is called Methanesulfonic acid, 1,1,1-trifluoro-, lithium salt (1:1), and it's also named as Lithium trifluoromethanesulphonate. With the CAS registry number of 33454-82-9, its product categories are Organic-metal Salt; Catalysts for Organic Synthesis; Classes of Metal Compounds; Homogeneous Catalysts; Li (Lithium) Compounds; Metal Triflates; Synthetic Organic Chemistry; Typical Metal Compounds.

Other characteristics of the Methanesulfonic acid, 1,1,1-trifluoro-, lithium salt (1:1) can be summarised as followings: (1)H-Bond Donor: 1; (2)H-Bond Acceptor: 6; (3)Rotatable Bond Count: 0; (4)Exact Mass: 156.975853; (5)MonoIsotopic Mass: 156.975853; (6)Topological Polar Surface Area: 62.8; (7)Heavy Atom Count: 9; (8)Formal Charge: 0; (9)Complexity: 158; (10)Isotope Atom Count: 0.

Uses of this chemical: The Methanesulfonic acid, 1,1,1-trifluoro-, lithium salt (1:1) could react with pyridine, and obtain the 1-fluoropyridinium triflate. This reaction needs the reagent of 10 percent F2-N2, and the solvent of acetonitrile. The yield is 87 %. In addition, this reaction should be taken for 3 hours at the temperature of -40 °C.

The Methanesulfonic acid, 1,1,1-trifluoro-, lithium salt (1:1) could react with pyridine, and obtain the 1-fluoropyridinium triflate

When you are using this chemical, please be cautious about it as the following: This chemical is irritating to eyes, respiratory system and skin. You should wear suitable protective clothing if you use it. In case of contacting with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure: 
1.SMILES: [Li].C(F)(F)(F)S(=O)(=O)O
2.InChI: InChI=1/CHF3O3S.Li/c2-1(3,4)8(5,6)7;/h(H,5,6,7);
3.InChIKey: WDGKXRCNMKPDSD-UHFFFAOYAM