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CAS 126674-98-4

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1-METHYL-3-(TRIFLUOROMETHYL)-1H-PYRAZOLE-4-CARBONYL CHLORIDE

Description:
1-Methyl-3-(trifluoromethyl)-1H-pyrazole-4-carbonyl chloride, with the CAS number 126674-98-4, is a chemical compound characterized by its pyrazole ring structure, which is a five-membered heterocyclic compound containing two nitrogen atoms. The presence of a trifluoromethyl group (-CF3) significantly influences its chemical properties, enhancing its lipophilicity and potentially its reactivity. The carbonyl chloride functional group (-COCl) indicates that it can act as an acyl chloride, making it reactive towards nucleophiles, which is useful in various synthetic applications. This compound is typically utilized in organic synthesis, particularly in the development of pharmaceuticals and agrochemicals. Its unique structure may impart specific biological activities, making it of interest in medicinal chemistry. Additionally, due to the presence of fluorine atoms, it may exhibit distinct physical properties, such as increased stability and altered solubility compared to non-fluorinated analogs. Safety precautions should be taken when handling this compound, as carbonyl chlorides can be corrosive and toxic.
Formula:C6H4ClF3N2O
InChI:InChI=1/C6H4ClF3N2O/c1-12-2-3(5(7)13)4(11-12)6(8,9)10/h2H,1H3
SMILES:Cn1cc(c(C(F)(F)F)n1)C(=O)Cl
Synonyms:
  • 1H-Pyrazole-4-carbonyl chloride, 1-methyl-3-(trifluoromethyl)- (9CI)
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