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CAS 618070-50-1

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Ethyl 3-(4-bromophenyl)-1-methyl-1H-pyrazole-5-carboxylate

Description:
Ethyl 3-(4-bromophenyl)-1-methyl-1H-pyrazole-5-carboxylate is a chemical compound characterized by its pyrazole core, which is a five-membered ring containing two nitrogen atoms. This compound features an ethyl ester functional group, contributing to its solubility and reactivity. The presence of a 4-bromophenyl substituent enhances its potential for biological activity, as halogenated aromatic compounds often exhibit unique interactions in medicinal chemistry. The methyl group at the 1-position of the pyrazole ring can influence the compound's steric and electronic properties, affecting its reactivity and interaction with biological targets. This compound is typically synthesized through multi-step organic reactions, and its structure can be confirmed using techniques such as NMR and mass spectrometry. Ethyl 3-(4-bromophenyl)-1-methyl-1H-pyrazole-5-carboxylate may have applications in pharmaceuticals, particularly in the development of new therapeutic agents, owing to the diverse biological activities associated with pyrazole derivatives.
Formula:C13H13BrN2O2
InChI:InChI=1S/C13H13BrN2O2/c1-3-18-13(17)12-8-11(15-16(12)2)9-4-6-10(14)7-5-9/h4-8H,3H2,1-2H3
InChI key:InChIKey=NNFCYDDVLOLQCT-UHFFFAOYSA-N
SMILES:C(OCC)(=O)C1=CC(=NN1C)C2=CC=C(Br)C=C2
Synonyms:
  • Ethyl 3-(4-bromophenyl)-1-methyl-1H-pyrazole-5-carboxylate
  • 1H-Pyrazole-5-carboxylic acid, 3-(4-bromophenyl)-1-methyl-, ethyl ester
  • Ethyl 5-(4-bromophenyl)-2-methylpyrazole-3-carboxylate
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