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CAS 512809-85-7

:

5-[(4-Bromo-3-nitro-1H-pyrazol-1-yl)methyl]-2-furancarboxylic acid

Description:
5-[(4-Bromo-3-nitro-1H-pyrazol-1-yl)methyl]-2-furancarboxylic acid is a chemical compound characterized by its unique structure, which includes a furan ring and a pyrazole moiety. The presence of a bromine atom and a nitro group on the pyrazole contributes to its reactivity and potential biological activity. This compound is likely to exhibit polar characteristics due to the carboxylic acid functional group, which can participate in hydrogen bonding, enhancing its solubility in polar solvents. The furan ring adds aromaticity and may influence the compound's electronic properties. Its molecular structure suggests potential applications in medicinal chemistry, particularly in the development of pharmaceuticals, due to the presence of bioactive functional groups. Additionally, the compound's stability and reactivity can be influenced by the substituents on the pyrazole ring, making it a subject of interest for further research in synthetic and medicinal chemistry. Overall, this compound exemplifies the complexity and diversity of organic molecules used in various chemical applications.
Formula:C9H6BrN3O5
InChI:InChI=1S/C9H6BrN3O5/c10-6-4-12(11-8(6)13(16)17)3-5-1-2-7(18-5)9(14)15/h1-2,4H,3H2,(H,14,15)
InChI key:InChIKey=RLWQKLOXFLKEPV-UHFFFAOYSA-N
SMILES:C(N1N=C(N(=O)=O)C(Br)=C1)C=2OC(C(O)=O)=CC2
Synonyms:
  • 5-[(4-Bromo-3-nitro-1H-pyrazol-1-yl)methyl]-2-furancarboxylic acid
  • 2-Furancarboxylic acid, 5-[(4-bromo-3-nitro-1H-pyrazol-1-yl)methyl]-
  • 5-({4-bromo-3-nitro-1H-pyrazol-1-yl}methyl)-2-furoic acid
  • 5-[(4-bromo-3-nitro-1H-pyrazol-1-yl)methyl]furan-2-carboxylic acid
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