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CAS 50920-49-5

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5-Methyl-1-(1-methylethyl)-1H-pyrazole-3-carboxylic acid

Description:
5-Methyl-1-(1-methylethyl)-1H-pyrazole-3-carboxylic acid, with the CAS number 50920-49-5, is an organic compound characterized by its pyrazole ring structure, which is a five-membered ring containing two nitrogen atoms. This compound features a carboxylic acid functional group, contributing to its acidity and potential reactivity. The presence of a methyl group and an isopropyl group on the pyrazole ring enhances its hydrophobic characteristics, influencing its solubility and interaction with biological systems. It is often studied for its potential applications in pharmaceuticals and agrochemicals, particularly due to its ability to act as a building block in the synthesis of more complex molecules. The compound's stability, reactivity, and solubility can vary based on environmental conditions such as pH and temperature. Additionally, its structural features may allow for specific interactions with biological targets, making it of interest in medicinal chemistry. Overall, 5-Methyl-1-(1-methylethyl)-1H-pyrazole-3-carboxylic acid exemplifies the diverse chemistry associated with pyrazole derivatives.
Formula:C8H12N2O2
InChI:InChI=1S/C8H12N2O2/c1-5(2)10-6(3)4-7(9-10)8(11)12/h4-5H,1-3H3,(H,11,12)
InChI key:InChIKey=XHVNUVQADNZGTF-UHFFFAOYSA-N
SMILES:C(O)(=O)C1=NN(C(C)C)C(C)=C1
Synonyms:
  • 1-Isopropyl-5-methyl-1H-pyrazole-3-carboxylic acid
  • 1H-Pyrazole-3-carboxylic acid, 5-methyl-1-(1-methylethyl)-
  • 5-Methyl-1-(1-methylethyl)-1H-pyrazole-3-carboxylic acid
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