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CAS 52867-42-2

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Methyl 2,5-dihydro-2-methyl-5-oxo-1H-pyrazole-3-carboxylate

Description:
Methyl 2,5-dihydro-2-methyl-5-oxo-1H-pyrazole-3-carboxylate, with CAS number 52867-42-2, is a chemical compound characterized by its pyrazole ring structure, which is a five-membered ring containing two nitrogen atoms. This compound features a carboxylate group and a methyl ester, contributing to its reactivity and solubility in organic solvents. It typically appears as a crystalline solid and is known for its potential applications in medicinal chemistry, particularly in the development of pharmaceuticals due to its bioactive properties. The presence of the keto group and the carboxylate moiety enhances its ability to participate in various chemical reactions, including condensation and substitution reactions. Additionally, its structural features may allow for interactions with biological targets, making it of interest in drug design. As with many organic compounds, handling should be done with care, considering safety data and potential hazards associated with its use.
Formula:C6H8N2O3
InChI:InChI=1S/C6H8N2O3/c1-8-4(6(10)11-2)3-5(9)7-8/h3H,1-2H3,(H,7,9)
InChI key:InChIKey=IYAQFZAPKKWPNU-UHFFFAOYSA-N
SMILES:C(OC)(=O)C1=CC(=O)NN1C
Synonyms:
  • 1H-pyrazole-3-carboxylic acid, 2,5-dihydro-2-methyl-5-oxo-, methyl ester
  • Methyl 2,5-dihydro-2-methyl-5-oxo-1H-pyrazole-3-carboxylate
  • Methyl 3-Hydroxy-1-Methylpyrazole-5-Carboxylate
  • NSC 196605
  • methyl 3-hydroxy-1-methyl-1H-pyrazole-5-carboxylate
  • Methyl 2-methyl-5-oxo-2,5-dihydro-1H-pyrazole-3-carboxylate
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