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CAS 175137-29-8

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Phenylmethyl 2-chloro-4-(trifluoromethyl)-5-pyrimidinecarboxylate

Description:
Phenylmethyl 2-chloro-4-(trifluoromethyl)-5-pyrimidinecarboxylate, identified by its CAS number 175137-29-8, is a chemical compound that belongs to the class of pyrimidine derivatives. This substance features a pyrimidine ring substituted with a chloro group and a trifluoromethyl group, which significantly influences its chemical reactivity and properties. The presence of the phenylmethyl group enhances its lipophilicity, potentially affecting its solubility in organic solvents. The trifluoromethyl group is known for imparting unique electronic properties, making the compound of interest in medicinal chemistry and agrochemical applications. Additionally, the chloro substituent can participate in nucleophilic substitution reactions, further expanding its utility in synthetic chemistry. Overall, this compound's structural characteristics suggest potential applications in drug development and as a building block in organic synthesis, although specific biological activities and applications would require further investigation.
Formula:C13H8ClF3N2O2
InChI:InChI=1S/C13H8ClF3N2O2/c14-12-18-6-9(10(19-12)13(15,16)17)11(20)21-7-8-4-2-1-3-5-8/h1-6H,7H2
InChI key:InChIKey=RJHJVPJLOZDZSJ-UHFFFAOYSA-N
SMILES:C(OCC1=CC=CC=C1)(=O)C=2C(C(F)(F)F)=NC(Cl)=NC2
Synonyms:
  • 4-Chlorobenzyl 2-Chloro-4-(Trifluoromethyl)Pyrimidine-5-Carboxylate
  • 5-Pyrimidinecarboxylic acid, 2-chloro-4-(trifluoromethyl)-, phenylmethyl ester
  • Benzyl 2-chloro-4-trifluoromethylpyrimidine-5-carboxylate
  • Phenylmethyl 2-chloro-4-(trifluoromethyl)-5-pyrimidinecarboxylate
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