406-95-1

Basic information

• Product Name: 2,2,2-TRIFLUOROETHYL ACETATE
• Synonyms: 2,2,2-TRIFLUOROETHYL ACETATE;Acetic acid 2,2,2-trifluoroethyl ester;2,2,2-Trifluoroethyl acetate 97%;2,2,2-Trifluoroethylacetate97%;2,2,2-Trifluoroethanol acetate;2-Acetoxy-1,1,1-trifluoroethane, 1-(2,2,2-Trifluoroethoxy)ethan-1-one, 2,2,2-Trifluoroethyl ethanoate;2,2,2-Trifluoroethyl ethanoate, Acetic acid 2,2,2-trifluoroethyl ester;Trifluoroethyl acetate
• CAS NO: 406-95-1
• Molecular Formula: C₄H₅F₃O₂
• Molecular Weight: 142.08
• EINECS: -0
• Mol File: 406-95-1.mol
• Article Data: 13

Chemical Properties

• Boiling Point: 78 °C
• Flash Point: 11°C
• Appearance: /
• Density: 1,258 g/cm3
• Refractive Index: 1.3202
• Water Solubility: Soluble in water (16 g/L) (25°C)
• BRN: 1757502
• CAS DataBase Reference: 2,2,2-TRIFLUOROETHYL ACETATE(CAS DataBase Reference)
• NIST Chemistry Reference: 2,2,2-TRIFLUOROETHYL ACETATE(406-95-1)
• EPA Substance Registry System: 2,2,2-TRIFLUOROETHYL ACETATE(406-95-1)

Safety Data

• Hazard Codes: F
• Statements: 11
• Safety Statements: 16-23-24/25
• RIDADR: 3272
• HazardClass: 3
• PackingGroup: III
• Hazardous Substances Data: 406-95-1(Hazardous Substances Data)

Usage

Description

2,2,2-Trifluoroethyl acetate is an organic compound that features a trifluoromethyl group attached to an ethyl acetate moiety. It is known for its unique chemical properties, which make it a versatile building block in the synthesis of various pharmaceuticals and chemical compounds.

Uses

Used in Pharmaceutical Industry:
2,2,2-Trifluoroethyl acetate is used as a synthetic intermediate for the preparation of various pharmaceutical compounds. Its unique structure and reactivity contribute to the development of new drugs with improved properties, such as enhanced bioavailability and selectivity.
Used in Chemical Synthesis:
In the chemical synthesis industry, 2,2,2-Trifluoroethyl acetate is used as a key building block for the creation of a wide range of chemical compounds. Its trifluoromethyl group imparts specific characteristics to the final products, making it valuable in the development of new materials with tailored properties.
Specific Application:
2,2,2-Trifluoroethyl trifluoroacetate, a derivative of 2,2,2-trifluoroethyl acetate, is used in the preparation of dimethyl (3,3,3-trifluoro-2,2-dihydroxypropyl)phosphonate. 2,2,2-TRIFLUOROETHYL ACETATE has potential applications in the development of new pharmaceuticals and other chemical products.

InChI:InChI=1/C4H5F3O2/c1-3(8)9-2-4(5,6)7/h2H2,1H3

Upstream product

• 75-89-8 2,2,2-trifluoroethanol 
• 75-36-5 acetyl chloride 
• 108-24-7 acetic anhydride 
• 64-19-7 acetic acid 
• 87938-02-1 2,2,5-Trimethyl-5-(2,2,2-trifluoro-ethoxy)-2,5-dihydro-[1,3,4]oxadiazole 
• 830-03-5 4-nitrophenol acetate 
• 115981-45-8 methyl(2,2,2-trifluoro-ethoxo){1,2-bis(diphenylphosphino)ethane}palladium 
• 75-88-7 1,1,1-trifluoro-2-chloroethane 
• 127-08-2 potassium acetate 
• 24265-37-0 2,2,2-trifluoroethoxide 
• 127-09-3 sodium acetate 

Downstream Products

• 1445-91-6 (S)-1-phenylethanol 
• 1517-69-7 (R)-1-phenylethanol 
• 16197-92-5 (R)-1-phenethyl acetate 
• 75-89-8 2,2,2-trifluoroethanol 
• 16197-93-6 (S)-1-phenylethyl acetate 
• 43041-12-9 methyl (2R)-pyrrolidine-2-carboxylate 
• 2311-25-3 N-acetyl-L-proline methyl ester 
• 58914-01-5 2,2,5-trimethyl-4-phenyl-5-(2,2,2-trifluoro-ethoxy)-2,5-dihydro-oxazole 
• 936493-84-4 2,2,2-trifluoro-1-(4-(5-fluoro-2-methylphenylsulfonyl)piperazin-1-yl)ethanone 
• 75-38-7 Vinylidene fluoride 
• 135257-28-2 (S)-6-Acetylamino-2-((S)-2-amino-3-phenyl-propionylamino)-hexanoic acid tert-butyl ester 
• 19028-69-4 (1-acetyl-piperidin-2-yl)-methanol 
• 19028-68-3 N-acetyl-2-acetoxymethylpiperidine 
• 143900-43-0 tert-butyl (3R)-3-hydroxypiperidine-1-carboxylate 

Relevant articles and documents

Imidazolium salt assisted hydrolysis of 1-chloro-2,2,2-trifluoroethane

The use of imidazolium-based ionic liquids as promoters was found to be highly effective for the hydrolysis reaction of CF3CH2Cl with aqueous potassium acetate to produce 2,2,2-trifluoroethanol (TFE). Among ionic liquids tested, 1-butyl-3-methylimidazoliu

EFFECT OF SOLVENT ON THE ESTERIFICATION BETWEEN 1,1,1-TRIFLUOROCHLORETHANE AND AKALINE ACETATE

-

BF3·2CF3CH2OH (BF 3·2TFE), an efficient superacidic catalyst for some organic synthetic transformations

BF3 · 2CF3CH2OH complex was found to be a very effective superacidic catalyst comparable in acid strength to at least that of 100% anhydrous sulfuric acid for various acid-catalyzed organic transformations such as isomerizations, rearrangements, ionic hydrogenation of various ketones, and aromatics with triethylsilane and nitration of aromatics with metal nitrate. Studies of the pivalaldehyde-methyl isopropyl ketone rearrangement and the benzopinacol to phenanthrene transformation suggest that the complex has an acidity comparable to that of 100% anhydrous sulfuric acid. The structure and properties of the 1:2 boron trifluoride-trifluoroethanol complex have been further studied using NMR (1H, 13C, 19F, 11B) and DFT calculations at the B3LYP/6- 311++G**//B3LYP/6-31G* level.