ChemicalBook--->CAS DataBase List--->1513-87-7

1513-87-7

1513-87-7 Structure

1513-87-7 Structure
IdentificationBack Directory
[Name]

TFEC
[CAS]

1513-87-7
[Synonyms]

TFEC
JACS-1513-87-7
tri (trifluoroethyl) carbonate
2,2,2-Trifluoroethanolcarbonic acid
bis(2,2,2-trifluoroethyl) carbonate
Bis(2,2,2-trifluoroethyl) Carbonate >
Ethanol, 2,2,2-trifluoro-, carbonate (2:1)
Carbonic Acid Bis(2,2,2-trifluoroethyl) Ester
[Molecular Formula]

C5H4F6O3
[MDL Number]

MFCD11857845
[MOL File]

1513-87-7.mol
[Molecular Weight]

226.074
Chemical PropertiesBack Directory
[Boiling point ]

118°C(lit.)
[density ]

1.470±0.06 g/cm3(Predicted)
[refractive index ]

1.3120 to 1.3160
[storage temp. ]

Store at room temperature, keep dry and cool
[solubility ]

Chloroform (Soluble), Methanol (Slightly)
[form ]

clear liquid
[color ]

Colorless to Almost colorless
[Major Application]

battery manufacturing
[InChI]

InChI=1S/C5H4F6O3/c6-4(7,8)1-13-3(12)14-2-5(9,10)11/h1-2H2
[InChIKey]

WLLOZRDOFANZMZ-UHFFFAOYSA-N
[SMILES]

C(OCC(F)(F)F)(=O)OCC(F)(F)F
Safety DataBack Directory
[Symbol(GHS) ]

Flame (GHS02)Exclamation Mark (GHS07)
GHS02,GHS07
[Signal word ]

Warning
[Hazard statements ]

H226-H315-H319-H335
[Precautionary statements ]

P210-P241-P261
[RIDADR ]

UN 3272 3/PG II
[WGK Germany ]

WGK 3
[HazardClass ]

3
[PackingGroup ]

II
[HS Code ]

2920901090
[Storage Class]

3 - Flammable liquids
[Hazard Classifications]

Eye Irrit. 2
Flam. Liq. 3
Skin Irrit. 2
Hazard InformationBack Directory
[Uses]

Bis(2,2,2-trifluoroethyl) carbonate (DFDEC) is a highly effective electrolyte additive th at is widely used in the battery industry to enhance the performance and stability of lithium-ion batteries. Its remarkable thermal and electrochemical stability make it an excellent choice for use in high-temperature and high-voltage applications. Recent studies have also highlighted other benefits of DFDEC in battery applications. For instance, it has been found th at DFDEC can improve the cycle performance of lithium metal cells by forming a LiF-rich solid electrolyte interphase (SEI).[1,2] Additionally, flammability tests have shown th at electrolytes containing over 60% v/v of DFDEC do not catch fire, demonstrating its potential as a flame-retardant.[3] These findings highlight the versatility and importance of DFDEC in the development of safe and high-performance battery technologies.
[Preparation]

A solution of 2,2,2-trifluoroethanol (200 g, 2.0 mol) and pyridine (158 g, 2.0 mol) in dry diethyl ether (1 L) was treated with phosgene (99 g, 1.0 mol). The reaction mixture was stirred overnight and then filtered. The filtrate was distilled to give 199 g (88%) of bis(2,2,2-trifluoroethyl) carbonate.
Spectrum DetailBack Directory
[Spectrum Detail]

TFEC(1513-87-7)1HNMR
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