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CAS 617709-79-2

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Methyl 5-formyl-1-(1-methylethyl)-1H-pyrazole-3-carboxylate

Description:
Methyl 5-formyl-1-(1-methylethyl)-1H-pyrazole-3-carboxylate, identified by its CAS number 617709-79-2, is a chemical compound characterized by its pyrazole ring structure, which is a five-membered heterocyclic compound containing two nitrogen atoms. This substance features a formyl group (-CHO) and a carboxylate group (-COOCH3) that contribute to its reactivity and potential applications in organic synthesis. The presence of the isopropyl group (1-methylethyl) enhances its steric properties, which can influence its interaction with other molecules. Methyl 5-formyl-1-(1-methylethyl)-1H-pyrazole-3-carboxylate is likely to exhibit properties typical of pyrazole derivatives, such as biological activity, making it of interest in medicinal chemistry. Its solubility and stability can vary depending on the solvent and environmental conditions. Overall, this compound's unique structure and functional groups position it as a valuable intermediate in the synthesis of more complex organic molecules.
Formula:C9H12N2O3
InChI:InChI=1S/C9H12N2O3/c1-6(2)11-7(5-12)4-8(10-11)9(13)14-3/h4-6H,1-3H3
InChI key:InChIKey=NCCZMWLKRGIIPE-UHFFFAOYSA-N
SMILES:C(C)(C)N1C(C=O)=CC(C(OC)=O)=N1
Synonyms:
  • Methyl 5-formyl-1-isopropylpyrazole-3-carboxylate
  • 1H-Pyrazole-3-carboxylic acid, 5-formyl-1-(1-methylethyl)-, methyl ester
  • Methyl 5-formyl-1-(1-methylethyl)-1H-pyrazole-3-carboxylate
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