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CAS 262609-07-4

:

1,3-Diethyl 2-(2,4,6-trifluorophenyl)propanedioate

Description:
1,3-Diethyl 2-(2,4,6-trifluorophenyl)propanedioate is an organic compound characterized by its ester functional groups and a trifluorophenyl substituent. This compound features a propanedioate backbone, which consists of two ester groups flanking a central carbon chain. The presence of the trifluorophenyl group significantly influences its chemical properties, including increased lipophilicity and potential reactivity due to the electronegative fluorine atoms. The diethyl groups contribute to the compound's overall hydrophobic character and may affect its solubility in various solvents. This substance is likely to exhibit interesting biological activity, making it of interest in pharmaceutical and agrochemical research. Additionally, the trifluoromethyl groups can enhance the stability and metabolic profile of the compound. As with many fluorinated compounds, it may also exhibit unique interactions with biological targets, potentially leading to novel applications. Safety and handling precautions should be observed due to the presence of fluorine, which can impart toxicity and environmental persistence.
Formula:C13H13F3O4
InChI:InChI=1S/C13H13F3O4/c1-3-19-12(17)11(13(18)20-4-2)10-8(15)5-7(14)6-9(10)16/h5-6,11H,3-4H2,1-2H3
InChI key:InChIKey=VCCISIBKCNTCLR-UHFFFAOYSA-N
SMILES:C(C(OCC)=O)(C(OCC)=O)C1=C(F)C=C(F)C=C1F
Synonyms:
  • 1,3-Diethyl 2-(2,4,6-trifluorophenyl)propanedioate
  • 2,4,6-Trifluorophenylmalonate diethyl ester
  • 2-(2,4,6-Trifluoro-phenyl)-malonic acid diethyl ester
  • 2-(2,4,6-Trifluorophenyl)malonic acid diethyl ester
  • Diethyl (2,4,6-Trifluorophenyl)Propanedioate
  • Diethyl 2,4,6-trifluorophenylmalonate
  • Diethyl 2-(2,4,6-trifluorophenyl)malonate
  • Propanedioic acid, (2,4,6-trifluorophenyl)-, diethyl ester
  • Propanedioic acid, 2-(2,4,6-trifluorophenyl)-, 1,3-diethyl ester
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