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CAS 720-01-4

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Ethyl 4-chloro-2-(trifluoromethyl)pyrimidine-5-carboxylate

Description:
Ethyl 4-chloro-2-(trifluoromethyl)pyrimidine-5-carboxylate, with the CAS number 720-01-4, is a chemical compound belonging to the pyrimidine family, characterized by its heterocyclic structure containing nitrogen atoms. This compound features a chloro substituent at the 4-position and a trifluoromethyl group at the 2-position of the pyrimidine ring, which significantly influences its chemical reactivity and physical properties. The presence of the ethyl ester group at the 5-position enhances its solubility in organic solvents and contributes to its potential applications in medicinal chemistry and agrochemicals. Ethyl 4-chloro-2-(trifluoromethyl)pyrimidine-5-carboxylate is typically a solid at room temperature and may exhibit moderate to high stability under standard conditions. Its unique functional groups make it a valuable intermediate in the synthesis of various pharmaceuticals and biologically active compounds. Additionally, the trifluoromethyl group is known to impart lipophilicity, which can affect the bioavailability and pharmacokinetics of derivatives synthesized from this compound.
Formula:C8H6ClF3N2O2
InChI:InChI=1/C8H6ClF3N2O2/c1-2-16-6(15)4-3-13-7(8(10,11)12)14-5(4)9/h3H,2H2,1H3
SMILES:CCOC(=O)c1cnc(C(F)(F)F)nc1Cl
Synonyms:
  • 5-Pyrimidinecarboxylic acid, 4-chloro-2-(trifluoromethyl)-, ethyl ester
  • Ethyl 4-chloro-2-(trifluoromethyl)-5-pyrimidinecarboxylate
  • Ethyl-4-chlor-2-(trifluormethyl)pyrimidin-5-carboxylat
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