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CAS 852228-09-2

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Ethyl 1-methyl-5-(trifluoromethyl)-1H-pyrazole-3-carboxylate

Description:
Ethyl 1-methyl-5-(trifluoromethyl)-1H-pyrazole-3-carboxylate is a chemical compound characterized by its pyrazole ring structure, which is a five-membered heterocyclic compound containing two nitrogen atoms. This substance features a trifluoromethyl group, which significantly influences its chemical properties, including increased lipophilicity and potential biological activity. The ethyl ester functional group contributes to its reactivity, making it suitable for various synthetic applications. The presence of the methyl group at the 1-position and the trifluoromethyl group at the 5-position of the pyrazole ring can enhance its stability and solubility in organic solvents. This compound is often studied for its potential use in pharmaceuticals and agrochemicals due to its unique structural features, which may impart specific biological activities. Additionally, the trifluoromethyl group is known to enhance the metabolic stability of compounds, making them more effective in biological systems. Overall, this compound exemplifies the diverse applications of pyrazole derivatives in medicinal chemistry and material science.
Formula:C8H9F3N2O2
InChI:InChI=1S/C8H9F3N2O2/c1-3-15-7(14)5-4-6(8(9,10)11)13(2)12-5/h4H,3H2,1-2H3
InChI key:InChIKey=KKZBEVWDQREDBA-UHFFFAOYSA-N
SMILES:C(F)(F)(F)C1=CC(C(OCC)=O)=NN1C
Synonyms:
  • 1H-Pyrazole-3-carboxylic acid, 1-methyl-5-(trifluoromethyl)-, ethyl ester
  • Ethyl 1-methyl-5-(trifluoromethyl)-1H-pyrazole-3-carboxylate
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