ChemicalBook--->CAS DataBase List--->90076-65-6

90076-65-6

90076-65-6 Structure

90076-65-6 Structure
IdentificationMore
[Name]

Lithium bis(trifluoromethanesulphonyl)imide
[CAS]

90076-65-6
[Synonyms]

BISTRIFLUOROMETHANESULFONIMIDE LITHIUM SALT
BIS(TRIFLUOROMETHANESULFONYL)IMIDE LITHIUM SALT
BIS(TRIFLUOROMETHYLSULFONYL)AMINE LITHIUM SALT
LITHIUM BISTRIFLUOROMETHANESULFONIMIDATE
LITHIUM BIS(TRIFLUOROMETHANESULFONIMIDE)
LITHIUM BIS(TRIFLUOROMETHANESULFONYL)IMIDE
LITHIUM BIS(TRIFLUOROMETHANESULPHONYL)IMIDE
LITHIUM TRIFLUOROMETHANESULFONIMIDE
N-LITHIOTRIFLUOROMETHANESULFONIMIDE
1,1,1-trifluoro-n-[(trifluoromethyl)sulfonyl]-methanesulfonamidlithiumsalt
lithiumbis(trifluoromethylsulfonyl)imide
Methanesulfonamide,1,1,1-trifluoro-N-[(trifluoromethyl)sulfonyl]-,lithiumsalt
bis(Trifluoromethanesulphonyl)imide, lithium salt
Bis(trifluoromethane)sulfonimide lithium salt, 99.95% metals basis
Lithium bis(trifluoromethanesulphonyl)imide 99%
Lithiumbis(trifluoromethanesulphonyl)imide99%
1,1,1-Trifluoro-N-[(trifluoromethyl)sulfonyl]methanesulfon amide lithium salt
Lithium bis(trifluoromethylsulfonyl)imide, 98+%
Bis(trifluoromethylsulfonyl)amine lithium salt, Lithium bistrifluoromethanesulfonimidate
[EINECS(EC#)]

415-300-0
[Molecular Formula]

C2F6LiNO4S2
[MDL Number]

MFCD00210017
[Molecular Weight]

287.09
[MOL File]

90076-65-6.mol
Chemical PropertiesBack Directory
[Appearance]

White hygroscopic powder
[Melting point ]

234-238 °C(lit.)
[density ]

1,334 g/cm3
[vapor pressure ]

0Pa at 25℃
[Fp ]

>100°C (>212°F)
[storage temp. ]

Inert atmosphere,Room Temperature
[solubility ]

H2O: 10 mg/mL, clear, colorless
[form ]

Hygroscopic Powder
[color ]

White
[Specific Gravity]

1.334
[Water Solubility ]

Soluble in water.
[Sensitive ]

Moisture Sensitive
[BRN ]

6625414
[InChI]

1S/C2F6NO4S2.Li/c3-1(4,5)14(10,11)9-15(12,13)2(6,7)8;/q-1;+1
[InChIKey]

QSZMZKBZAYQGRS-UHFFFAOYSA-N
[SMILES]

[Li]N(S(=O)(=O)C(F)(F)F)S(=O)(=O)C(F)(F)F
[LogP]

-1.46
[CAS DataBase Reference]

90076-65-6(CAS DataBase Reference)
[EPA Substance Registry System]

90076-65-6(EPA Substance)
[Boiling point ]

234-238?°C (lit.)
[Description]

Lithium bis(trifluoromethylsulphonyl)imide (LiTFSI) is normally used as a p-dopant?to enhance the conductivity and hole mobility of the?Spiro-OMeTAD for perovskite solar cells. It is believed that The function of LiTFSI in PSCs is?similar to that in solid-state dye-sensitised solar cells [2].
Safety DataBack Directory
[Symbol(GHS) ]

Corrosion (GHS05)Skull and Crossbones (GHS06)Health Hazard (GHS08)
GHS05,GHS06,GHS08
[Signal word ]

Danger
[Hazard statements ]

H301+H311-H314-H373-H412
[Precautionary statements ]

P260-P273-P280-P303+P361+P353-P304+P340+P310-P305+P351+P338
[Hazard Codes ]

T,C
[Risk Statements ]

R24/25:Toxic in contact with skin and if swallowed .
R34:Causes burns.
R52/53:Harmful to aquatic organisms, may cause long-term adverse effects in the aquatic environment .
[Safety Statements ]

S22:Do not breathe dust .
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection .
S45:In case of accident or if you feel unwell, seek medical advice immediately (show label where possible) .
S61:Avoid release to the environment. Refer to special instructions safety data sheet .
[RIDADR ]

UN 2923 8/PG 2
[WGK Germany ]

2
[Hazard Note ]

Harmful/Corrosive/Moisture Sensitive
[TSCA ]

Yes
[REACH Registrations]

Active
[HazardClass ]

8
[PackingGroup ]

II
[HS Code ]

29309090
[Storage Class]

6.1B - Non-combustible acute toxic Cat. 1 and 2
very toxic hazardous materials
[Hazard Classifications]

Acute Tox. 3 Dermal
Acute Tox. 3 Oral
Aquatic Chronic 3
Eye Dam. 1
Skin Corr. 1B
STOT RE 2 Oral
Raw materials And Preparation ProductsBack Directory
[Preparation Products]

1-Ethyl-3-methylimidazolium bis(trifluoromethylsulfonyl)imide-->1-Butyl-3-methylimidazolium bis(trifluor-->Trihexyl(tetradecyl)phosphonium bis(trifluoromethylsulfonyl)imide-->1-Butyl-3-methylpyridinium bis(trifluorm-->1-Dodecyl-3-methylimidazolium bis(trifluoromethylsulfonyl)imide-->Ethyl-dimethyl-propylammonium bis(trifluoromethylsulfonyl)imide-->Tetramethylammonium bis(trifluoromethylsulfonyl)imide-->1,2-Dimethyl-3-octyl-1H-imidazolium salt with 1,1,1-trifluoro-N-[(trifluoromethyl)sulfonyl]methanesulfonamide
Hazard InformationBack Directory
[Chemical Properties]

White hygroscopic powder
[Uses]

An electrolyte
[Uses]

It finds application in the preparation of rare-earth Lewis acid catalysts.
[General Description]

Bis(trifluoromethane)sulfonimide lithium salt is a synthetic reagent.
[Flammability and Explosibility]

Nonflammable
[Battery Materials]

The non-isothermal kinetics of poly (ε-caprolactone) (PCL):lithium bis(trifluoromethanesulfonyl) imide (LiTFSI) and PEO:LiTFSI systems were explored, leading to the identification of different behaviors of effective crystal growth rate dependencies with temperature for PEO:LiTFSI (linear) and PCL:LiTFSI (exponential). Comparative study of these two SPE systems enabled the advancement of understanding on the role of LiTFSI in the crystallization process for both poly (ether) and poly (ester) based solid polymer electrolytes[1].
[Synthesis]

5.91 g of anhydrous lithium fluoride and N-butyl-bistrifluoromethylsulfonimide 51.26 g. Add to 250 g of isopropyl acetate and reflux for 10 hours. It was filtered after being cooled to room temperature, and the filtrate was concentrated to dryness under reduced pressure.200 g of dichloromethane was added dropwise, and the mixture was stirred at 20 ° C for 2 hours and then filtered. Wash with dichloromethane. The filter cake was dried at 80 ° C to obtain 39.57 g of Lithium bis(trifluoromethanesulphonyl)imide. The yield is 90.7%.
Lithium bis(trifluoromethanesulphonyl)imide
[Properties and Applications]

Lithium bis(trifluoromethanesulphonyl)imide (LiTFSI) is a hydrophilic organic salt with many uses in electric and electronic systems. Its bis(trifluoromethane)sulfonimide anion, often called bistriflimide, is helpful in coordinating weakly with cations. LiTFSI's other important property is its extremely high solubility in water: 21 molal or ≈6 kg/L of solution. LiTFSI is safer than the formerly used salt, lithium hexafluorophosphate (LiPF6). To improve the cells' ability to transport electrical charges, researchers are doped with a combination of LiTFSI and a semiconductor called Spiro-OMeTAD1; however, this process is extremely slow. Taylor and his fellow researchers solved the problem by bubbling carbon dioxide into a solution of spiro-OMeTAD and LiTFSI while irradiating the mixture with ultraviolet light. They then cast a film from the solution onto the perovskite light absorber. The process can be completed in ≈1 minute, compared with the older, hours-long doping procedure.
[Toxics Screening Level]

There are two Initial Threshold Screening Levels (ITSLs) for lithium bis(trifluoromethane sulfonyl)imide (LiTFMSI) (CAS No. 90076-65-6): Acute ITSL: 40 μg/m3 with a 24-hr. averaging time, and Chronic ITSL: 1 μg/m3 with an annual averaging time
[References]

[1] Perodeau, T., Vargas, J. A., Dollé, M., & Laventure, A. (2026). Exploring the impact of LiTFSI on solid polymer electrolytes crystallization behavior. Polymer, 352, Article 129839. https://doi.org/10.1016/j.polymer.2026.129839
Spectrum DetailBack Directory
[Spectrum Detail]

Lithium bis(trifluoromethanesulphonyl)imide(90076-65-6)13CNMR
Lithium bis(trifluoromethanesulphonyl)imide(90076-65-6)19FNMR
Lithium bis(trifluoromethanesulphonyl)imide(90076-65-6)19FNMR
Lithium bis(trifluoromethanesulphonyl)imide(90076-65-6)13CNMR
Lithium bis(trifluoromethanesulphonyl)imide(90076-65-6)IR
Lithium bis(trifluoromethanesulphonyl)imide(90076-65-6)FT-IR
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

Lithium bis(trifluoromethanesulfonimide), 99%(90076-65-6)
[Alfa Aesar]

Lithium bis(trifluoromethylsulfonyl)imide, 98+%(90076-65-6)
[Sigma Aldrich]

90076-65-6(sigmaaldrich)
[TCI AMERICA]

Lithium Bis(trifluoromethanesulfonyl)imide,>98.0%(T)(90076-65-6)
90076-65-6 suppliers list
Company Name: SHANGHAI YUANYANG NEW MATERIAL TECHNOLOGY CO., LTD  Gold
Telephone: 021-61041811 18621952195
Website: www.enyochem.com/
Company Name: Peric Specialty Gases  Gold
Telephone: 15694909569
Website: www.pericsg.com/
Company Name: JIANGXI TIME PHARMACEUTICAL CO.,LTD  Gold
Telephone: 0794-7183888 13155888520
Website: http://www.groupchem.com
Company Name: Shanghai Furui Fine Chemicals Co., Ltd.  Gold
Telephone: 021-36041048 13361903612
Website: http://www.shf2chem.com/
Company Name: West fluorine technology co., ltd  Gold
Telephone: 0531-85906692 15588812394
Website: www.sifluoro.com
Company Name: Shandong Hemao New Material Co., Ltd.  Gold
Telephone: 13061243681
Website: https://www.cnhemiao.com
Company Name: Jinan Qicheng Chemical Co. , Ltd.  Gold
Telephone: 0531-15628998092 15628998092
Website: https://www.chemicalbook.com/supplier/25494127/
Company Name: Shanghai Oujin Lithium Industrial., Ltd  Gold
Telephone: 13564718081 13564718081
Website: www.sh-oujin.com/
Company Name: Shanghai Jiahua Herong Biotechnology Co., Ltd  Gold
Telephone: 18916155073
Website: www.chemhigh.com/
Company Name: Tianjin Zhongxin Chemtech Co., Ltd.  
Telephone: 022-66880623
Website: http://www.tjzxchem.com
Company Name: J & K SCIENTIFIC LTD.  
Telephone: 18210857532 18210857532
Website: https://www.jkchemical.com
Company Name: Meryer (Shanghai) Chemical Technology Co., Ltd.  
Telephone: 4006356688 18621169109
Website: www.x-labseek.com/
Company Name: 3B Pharmachem (Wuhan) International Co.,Ltd.  
Telephone: 18930552037
Website: www.chemicalbook.com/showsupplierproductslist13285/0_en.htm
Company Name: Alfa Aesar  
Telephone: 400-6106006
Website: http://chemicals.thermofisher.cn
Company Name: TCI (Shanghai) Development Co., Ltd.  
Telephone: 021-67121386
Website: https://www.tcichemicals.com/CN/zh/
Company Name: Beijing dtftchem Technology Co., Ltd.  
Telephone: 010-60275820 13031183356
Website: www.dtfchem.com
Company Name: Beijing HwrkChemical Technology Co., Ltd  
Telephone: 89508211 18501085097
Website: www.hwrkchemical.com
Company Name: Energy Chemical  
Telephone: 400-0056266
Website: www.energy-chemical.com
Tags:90076-65-6 Related Product Information
123-56-8 541-59-3 13676-54-5 106-20-7 62-53-3 82113-65-3 421-83-0 7447-41-8 3658-77-3 534-03-2 4039-32-1 85-41-6 16853-85-3 2923-28-6 124-63-0 7439-93-2 7803-58-9 75-46-7