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CAS 946386-49-8

:

4-Bromo-1,2-dihydro-1-methyl-5-[(4-nitrophenoxy)methyl]-2-phenyl-3H-pyrazol-3-one

Description:
4-Bromo-1,2-dihydro-1-methyl-5-[(4-nitrophenoxy)methyl]-2-phenyl-3H-pyrazol-3-one is a synthetic organic compound characterized by its complex structure, which includes a pyrazolone core, a bromine substituent, and a nitrophenoxy group. This compound typically exhibits a range of chemical properties, including moderate solubility in organic solvents and potential reactivity due to the presence of electrophilic and nucleophilic sites. The bromine atom can influence its reactivity and stability, while the nitrophenoxy group may enhance its electronic properties, making it suitable for various applications in medicinal chemistry and material science. The presence of multiple aromatic rings contributes to its potential for π-π stacking interactions, which can be significant in biological systems or when used as a ligand in coordination chemistry. Additionally, the compound may exhibit biological activity, which warrants further investigation for potential pharmaceutical applications. Overall, its unique structural features make it a compound of interest in both research and industrial contexts.
Formula:C17H14BrN3O4
InChI:InChI=1S/C17H14BrN3O4/c1-19-15(11-25-14-9-7-13(8-10-14)21(23)24)16(18)17(22)20(19)12-5-3-2-4-6-12/h2-10H,11H2,1H3
InChI key:InChIKey=QXZATGLSLUUDCR-UHFFFAOYSA-N
SMILES:CN1N(C(=O)C(Br)=C1COC2=CC=C(N(=O)=O)C=C2)C3=CC=CC=C3
Synonyms:
  • 4-Bromo-1,2-dihydro-1-methyl-5-[(4-nitrophenoxy)methyl]-2-phenyl-3H-pyrazol-3-one
  • 3H-Pyrazol-3-one, 4-bromo-1,2-dihydro-1-methyl-5-[(4-nitrophenoxy)methyl]-2-phenyl-
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