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CAS 959582-69-5

:

1-(3-Bromophenyl)-3,5-dimethyl-1H-pyrazole-4-carboxylic acid

Description:
1-(3-Bromophenyl)-3,5-dimethyl-1H-pyrazole-4-carboxylic acid is a chemical compound characterized by its pyrazole core, which is a five-membered ring containing two nitrogen atoms. The presence of a bromophenyl group at the 1-position and two methyl groups at the 3 and 5 positions contributes to its unique properties. This compound features a carboxylic acid functional group at the 4-position, which enhances its acidity and reactivity. It is typically a solid at room temperature and may exhibit moderate solubility in polar solvents due to the carboxylic acid group. The bromine substituent can influence its electronic properties and reactivity, making it a potential candidate for various chemical reactions, including nucleophilic substitutions and coupling reactions. Additionally, compounds of this nature may have applications in medicinal chemistry, particularly in the development of pharmaceuticals, due to their ability to interact with biological targets. Overall, the structural features of 1-(3-Bromophenyl)-3,5-dimethyl-1H-pyrazole-4-carboxylic acid suggest a versatile compound with potential utility in both research and industry.
Formula:C12H11BrN2O2
InChI:InChI=1S/C12H11BrN2O2/c1-7-11(12(16)17)8(2)15(14-7)10-5-3-4-9(13)6-10/h3-6H,1-2H3,(H,16,17)
InChI key:InChIKey=GKWQVACDLZXGEF-UHFFFAOYSA-N
SMILES:CC=1N(N=C(C)C1C(O)=O)C2=CC(Br)=CC=C2
Synonyms:
  • 1-(3-Bromophenyl)-3,5-dimethyl-1H-pyrazole-4-carboxylic acid
  • 1H-Pyrazole-4-carboxylic acid, 1-(3-bromophenyl)-3,5-dimethyl-
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