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CAS 175137-36-7

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1-(4-Nitrophenyl)-5-(trifluoromethyl)pyrazole-4-carbonyl chloride

Description:
1-(4-Nitrophenyl)-5-(trifluoromethyl)pyrazole-4-carbonyl chloride is a chemical compound characterized by its unique structural features, which include a pyrazole ring substituted with a nitrophenyl group and a trifluoromethyl group. The presence of the carbonyl chloride functional group indicates that it is a reactive compound, often used in organic synthesis and medicinal chemistry. This compound is typically a solid at room temperature and may exhibit moderate to high solubility in organic solvents, depending on the solvent's polarity. Its trifluoromethyl group contributes to its lipophilicity and can enhance biological activity, making it of interest in pharmaceutical research. The nitro group may also influence the compound's electronic properties and reactivity. Safety precautions should be taken when handling this compound, as carbonyl chlorides can be corrosive and toxic. Overall, this compound's unique combination of functional groups makes it a valuable intermediate in the synthesis of more complex molecules.
Formula:C13H10F4N2O2
InChI:InChI=1/C13H10F4N2O2/c1-2-21-12(20)10-7-18-19(11(10)13(15,16)17)9-5-3-8(14)4-6-9/h3-7H,2H2,1H3
SMILES:CCOC(=O)c1cnn(c2ccc(cc2)F)c1C(F)(F)F
Synonyms:
  • 1-(4-Nitrophenyl)-5-(trifluoromethyl)-1H-pyrazole-4-carbonyl chloride
  • ethyl 1-(4-fluorophenyl)-5-(trifluoromethyl)-1H-pyrazole-4-carboxylate
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