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CAS 154934-97-1

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5-Ethoxycarbonyl-4-(trifluoromethyl)pyrimidin-2(1H)-one

Description:
5-Ethoxycarbonyl-4-(trifluoromethyl)pyrimidin-2(1H)-one is a heterocyclic organic compound characterized by its pyrimidine ring structure, which is a six-membered ring containing two nitrogen atoms at positions 1 and 3. This compound features an ethoxycarbonyl group at the 5-position and a trifluoromethyl group at the 4-position, contributing to its unique chemical properties. The presence of the trifluoromethyl group enhances the compound's lipophilicity and can influence its reactivity and biological activity. The ethoxycarbonyl moiety provides a carbonyl functionality that can participate in various chemical reactions, such as nucleophilic attacks. This compound is of interest in medicinal chemistry and agrochemicals due to its potential applications in drug development and as a building block for synthesizing more complex molecules. Its specific physical properties, such as melting point, solubility, and spectral characteristics, would typically be determined through experimental methods and can vary based on the conditions of synthesis and purification.
Formula:C8H7F3N2O3
InChI:InChI=1/C8H7F3N2O3/c1-2-16-6(14)4-3-12-7(15)13-5(4)8(9,10)11/h3H,2H2,1H3,(H,12,13,15)
SMILES:CCOC(=O)c1cnc(nc1C(F)(F)F)O
Synonyms:
  • Ethyl 2-oxo-4-(trifluoromethyl)-1,2-dihydropyrimidine-5-carboxylate
  • Ethyl 2-Oxo-6-(Trifluoromethyl)-1,2-Dihydropyrimidine-5-Carboxylate
  • 2-Hydroxy-4-trifluoromethyl-pyrimidine-5-carboxylic acid ethyl ester
  • Ethyl 2-hydroxy-4-(trifluoromethyl)pyrimidine-5-carboxylate
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