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CAS 13788-94-8

:

3,5-Dimethyl-1-(4-nitrophenyl)-1H-pyrazole

Description:
3,5-Dimethyl-1-(4-nitrophenyl)-1H-pyrazole is an organic compound characterized by its pyrazole core, which is a five-membered ring containing two nitrogen atoms. This compound features two methyl groups at the 3 and 5 positions of the pyrazole ring, contributing to its hydrophobic character and influencing its solubility and reactivity. The presence of a 4-nitrophenyl group at the 1-position introduces an electron-withdrawing nitro group, which can enhance the compound's reactivity in electrophilic substitution reactions and may affect its biological activity. The molecular structure suggests potential applications in pharmaceuticals, agrochemicals, or as a building block in organic synthesis. Its CAS number, 13788-94-8, allows for easy identification in chemical databases. The compound's properties, such as melting point, boiling point, and solubility, would depend on the specific conditions and purity of the sample. Overall, 3,5-Dimethyl-1-(4-nitrophenyl)-1H-pyrazole is a versatile compound with potential utility in various chemical applications.
Formula:C11H11N3O2
InChI:InChI=1S/C11H11N3O2/c1-8-7-9(2)13(12-8)10-3-5-11(6-4-10)14(15)16/h3-7H,1-2H3
InChI key:InChIKey=ULPBJGVRVXWECP-UHFFFAOYSA-N
SMILES:CC=1N(N=C(C)C1)C2=CC=C(N(=O)=O)C=C2
Synonyms:
  • 1-(4-Nitrophenyl)-3,5-dimethyl-pyrazole
  • 1H-pyrazole, 3,5-dimethyl-1-(4-nitrophenyl)-
  • 3,5-Dimethyl-1-(4-nitrophenyl)pyrazole
  • 3,5-Dimethyl-1-(p-nitrophenyl)pyrazole
  • NSC 75244
  • Pyrazole, 3,5-dimethyl-1-(p-nitrophenyl)-
  • 3,5-Dimethyl-1-(4-nitrophenyl)-1H-pyrazole
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