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CAS 6647-98-9

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4-iodo-1-methyl-1H-pyrazole-3-carboxylic acid

Description:
4-Iodo-1-methyl-1H-pyrazole-3-carboxylic acid is a heterocyclic organic compound characterized by its pyrazole ring structure, which includes a methyl group and a carboxylic acid functional group. The presence of the iodine atom at the 4-position of the pyrazole ring contributes to its unique reactivity and potential applications in various chemical reactions, including nucleophilic substitutions and coupling reactions. This compound is typically a solid at room temperature and may exhibit moderate solubility in polar solvents due to the carboxylic acid group, which can engage in hydrogen bonding. Its molecular structure allows for potential applications in pharmaceuticals, agrochemicals, and as a building block in organic synthesis. Additionally, the presence of the iodine atom may impart specific biological activities or enhance the compound's properties for use in medicinal chemistry. As with many halogenated compounds, safety precautions should be taken when handling this substance due to potential toxicity and environmental impact.
Formula:C5H5IN2O2
InChI:InChI=1S/C5H5IN2O2/c1-8-2-3(6)4(7-8)5(9)10/h2H,1H3,(H,9,10)
InChI key:InChIKey=UQPXGRAYQOWZOD-UHFFFAOYSA-N
SMILES:C(O)(=O)C1=NN(C)C=C1I
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