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CAS 78208-72-7

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5-Isopropyl-1H-pyrazole-3-carboxylic acid ethyl ester

Description:
5-Isopropyl-1H-pyrazole-3-carboxylic acid ethyl ester is an organic compound characterized by its pyrazole ring structure, which is a five-membered heterocyclic compound containing two nitrogen atoms. This substance features an isopropyl group at the 5-position and an ethyl ester functional group at the carboxylic acid moiety. The presence of the isopropyl group contributes to its hydrophobic characteristics, while the ethyl ester enhances its solubility in organic solvents. This compound is typically used in various chemical syntheses and may exhibit biological activity, making it of interest in pharmaceutical research. Its molecular structure allows for potential interactions with biological targets, which can be explored for therapeutic applications. The compound's stability, reactivity, and solubility are influenced by the functional groups present, making it a versatile building block in organic synthesis. As with many pyrazole derivatives, it may also exhibit specific pharmacological properties, warranting further investigation into its potential uses in medicinal chemistry.
Formula:C9H14N2O2
InChI:InChI=1S/C9H14N2O2/c1-4-13-9(12)8-5-7(6(2)3)10-11-8/h5-6H,4H2,1-3H3,(H,10,11)
InChI key:InChIKey=ILTUMWMASHHTOQ-UHFFFAOYSA-N
SMILES:C(OCC)(=O)C=1C=C(C(C)C)NN1
Synonyms:
  • 1H-Pyrazole-3-carboxylic acid, 5-(1-methylethyl)-, ethyl ester
  • 1H-pyrazole-5-carboxylic acid, 3-(1-methylethyl)-, ethyl ester
  • 3-Isopropyl-1H-pyrazole-5-carboxylic acid ethyl ester
  • 5-Isopropyl-1H-pyrazole-3-carboxylic acid ethyl ester
  • Ethyl 5-isopropyl-1H-pyrazole-3-carboxylate
  • ethyl 3-(propan-2-yl)-1H-pyrazole-5-carboxylate
  • ethyl 3-isopropyl-1H-pyrazole-5-carboxylate
  • ethyl 5-(1-methylethyl)-1H-pyrazole-3-carboxylate
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