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HomeProduct name list4,4,4-TRIFLUORO-1-(2-FURYL)-1,3-BUTANEDIONE

4,4,4-TRIFLUORO-1-(2-FURYL)-1,3-BUTANEDIONE

  • CAS NO.:326-90-9
  • Empirical Formula: C8H5F3O3
  • Molecular Weight: 206.12
  • MDL number: MFCD00020935
  • EINECS: 206-315-1
  • SAFETY DATA SHEET (SDS)
  • Update Date: 2023-04-23 13:52:06
4,4,4-TRIFLUORO-1-(2-FURYL)-1,3-BUTANEDIONE Structural

What is 4,4,4-TRIFLUORO-1-(2-FURYL)-1,3-BUTANEDIONE?

Chemical properties

clear yellow liquid

The Uses of 4,4,4-TRIFLUORO-1-(2-FURYL)-1,3-BUTANEDIONE

4,4,4-Trifluoro-1-(2-furyl)-1,3-butanedione (tfa) may be used in the following studies:

  • As capping ligand in the synthesis of [Eu(tfa)3]2bpm complexes (bpm=2,2′-bipyrimidine).
  • As reagent in the multistep synthesis of [13CD2]benzylamine.
  • As reagent in the synthesis of 3-trifluoromethyl-2-arylcarbonylquinoxaline 1,4-di-N-oxide derivatives by reacting with corresponding benzofurazan oxides.
  • In the efficient syntheses of perfluoroalkyl substituted azoles.
  • Synthesis of 2-arylcarbonyl-3-trifluoromethylquinoxaline 1,4-di-N-oxide derivatives.

What are the applications of Application

4,4,4-Trifluoro-1-(2-furyl)-1,3-butanedione is employed in the efficient synthesis of perfluoroalkyl substituted azoles

General Description

4,4,4-Trifluoro-1-(2-furyl)-1,3-butanedione (furoyltrifluoroacetone, FTFA) is a β-diketone. Its cytotoxic activity against human cultured tumor and normal cells has been evaluated. Reports suggest that 4,4,4-trifluoro-1-(2-furyl)-1,3-butanedione partially inhibits the oxidation of ferrocyanide in ETP (electron transport particles) isolated from beef heart mitochondria. Its reaction with N,N,N′,N′-tetramethylalkyl diamines to form ionic adducts has been investigated. The conformational analysis of the enol and keto form of FTFA has been reported.

Properties of 4,4,4-TRIFLUORO-1-(2-FURYL)-1,3-BUTANEDIONE

Melting point: 19-21 °C(lit.)
Boiling point: 203 °C(lit.)
Density  1.391 g/mL at 25 °C(lit.)
refractive index  n20/D 1.528(lit.)
Flash point: 189 °F
storage temp.  2-8°C
form  powder to lump to clear liquid
pka 5.56±0.23(Predicted)
color  White or Colorless to Yellow to Orange
FreezingPoint  20.0 to 22.0 ℃
BRN  168085
CAS DataBase Reference 326-90-9(CAS DataBase Reference)
EPA Substance Registry System 1,3-Butanedione, 4,4,4-trifluoro-1-(2-furanyl)- (326-90-9)

Safety information for 4,4,4-TRIFLUORO-1-(2-FURYL)-1,3-BUTANEDIONE

Signal word Warning
Pictogram(s)
ghs
Exclamation Mark
Irritant
GHS07
GHS Hazard Statements H227:Flammable liquids
H315:Skin corrosion/irritation
H319:Serious eye damage/eye irritation
H335:Specific target organ toxicity, single exposure;Respiratory tract irritation
Precautionary Statement Codes P261:Avoid breathing dust/fume/gas/mist/vapours/spray.
P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing.
P405:Store locked up.

Computed Descriptors for 4,4,4-TRIFLUORO-1-(2-FURYL)-1,3-BUTANEDIONE

InChIKey OWLPCALGCHDBCN-UHFFFAOYSA-N

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