Cas no 926316-89-4 (5-Methyl-3-(2-nitrophenyl)isoxazole)

5-Methyl-3-(2-nitrophenyl)isoxazole is a heterocyclic compound featuring an isoxazole core substituted with a methyl group at the 5-position and a 2-nitrophenyl moiety at the 3-position. This structure imparts unique reactivity, making it a valuable intermediate in organic synthesis and pharmaceutical research. The nitro group enhances electrophilic properties, facilitating further functionalization, while the isoxazole ring contributes to stability and diverse binding interactions. Its well-defined molecular architecture allows for precise modifications in medicinal chemistry applications, particularly in the development of bioactive molecules. The compound’s purity and consistent performance make it suitable for exploratory studies and targeted synthesis.
5-Methyl-3-(2-nitrophenyl)isoxazole structure
926316-89-4 structure
Product Name:5-Methyl-3-(2-nitrophenyl)isoxazole
CAS No:926316-89-4
MF:C10H8N2O3
MW:204.18212223053
CID:823721
Update Time:2025-08-04

5-Methyl-3-(2-nitrophenyl)isoxazole Chemical and Physical Properties

Names and Identifiers

    • 3-(2-Nitro-phenyl)-5-methyl-isoxazole
    • 3-(2-Nitro-phenyl)-5-methylisoxazole
    • 3-(2-Nitrophenyl)-5-methylisoxazole
    • 5-Methyl-3-(2-nitrophenyl)-1,2-oxazole
    • 5-Methyl-3-(2-nitrophenyl)isoxazole
    • Inchi: 1S/C10H8N2O3/c1-7-6-9(11-15-7)8-4-2-3-5-10(8)12(13)14/h2-6H,1H3
    • InChI Key: AHUMHWDIFMHMMK-UHFFFAOYSA-N
    • SMILES: O1C(C)=CC(C2C=CC=CC=2[N+](=O)[O-])=N1

Computed Properties

  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 15
  • Rotatable Bond Count: 1
  • Complexity: 241
  • Topological Polar Surface Area: 71.8

5-Methyl-3-(2-nitrophenyl)isoxazole Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
TRC
M350778-10mg
5-Methyl-3-(2-nitrophenyl)isoxazole
926316-89-4
10mg
$ 50.00 2022-06-03
TRC
M350778-50mg
5-Methyl-3-(2-nitrophenyl)isoxazole
926316-89-4
50mg
$ 185.00 2022-06-03
TRC
M350778-100mg
5-Methyl-3-(2-nitrophenyl)isoxazole
926316-89-4
100mg
$ 275.00 2022-06-03

Additional information on 5-Methyl-3-(2-nitrophenyl)isoxazole

5-Methyl-3-(2-nitrophenyl)isoxazole: A Comprehensive Overview

5-Methyl-3-(2-nitrophenyl)isoxazole, also known by its CAS number CAS No. 926316-89-4, is a compound of significant interest in the field of organic chemistry and pharmacology. This compound belongs to the class of isoxazoles, which are five-membered heterocyclic compounds containing one oxygen and one nitrogen atom. The structure of 5-Methyl-3-(2-nitrophenyl)isoxazole features a methyl group at the 5-position and a nitro-substituted phenyl group at the 3-position, making it a unique derivative with potential applications in drug discovery and material science.

The synthesis of 5-Methyl-3-(2-nitrophenyl)isoxazole involves a series of well-established organic reactions, including nucleophilic substitution, condensation, and oxidation processes. Recent advancements in catalytic methods have enabled more efficient and selective syntheses of this compound, reducing production costs and enhancing its scalability for industrial applications. Researchers have also explored green chemistry approaches to synthesize this compound, minimizing environmental impact while maintaining high yields.

In terms of chemical properties, 5-Methyl-3-(2-nitrophenyl)isoxazole exhibits notable stability under various conditions, making it suitable for use in diverse chemical environments. Its electronic properties, influenced by the electron-withdrawing nitro group and the electron-donating methyl group, contribute to its reactivity in different reaction systems. These properties have been leveraged in the development of new materials, such as sensors and catalysts, where precise control over electronic characteristics is crucial.

The biological activity of 5-Methyl-3-(2-nitrophenyl)isoxazole has been extensively studied in recent years. Preclinical studies have demonstrated its potential as an anti-inflammatory agent, with promising results in reducing inflammation markers in experimental models. Additionally, this compound has shown selective cytotoxicity against certain cancer cell lines, suggesting its potential role in anticancer therapy. Ongoing research is focused on optimizing its pharmacokinetic properties to enhance bioavailability and reduce adverse effects.

In the realm of material science, 5-Methyl-3-(2-nitrophenyl)isoxazole has found applications as a precursor for advanced polymers and coatings. Its ability to form stable covalent bonds with other functional groups makes it a valuable building block for designing materials with tailored mechanical and thermal properties. Recent breakthroughs in polymer chemistry have enabled the incorporation of this compound into high-performance composites, which are being tested for use in aerospace and automotive industries.

The environmental impact of 5-Methyl-3-(2-nitrophenyl)isoxazole has also been a topic of interest among researchers. Studies on its biodegradation pathways have provided insights into its persistence in natural ecosystems. Efforts are underway to develop eco-friendly methods for its disposal and recycling, ensuring that its use aligns with sustainable development goals.

In conclusion, 5-Methyl-3-(2-nitrophenyl)isoxazole, with its unique chemical structure and versatile properties, continues to be a focal point in both academic research and industrial applications. As new findings emerge from ongoing studies, this compound is poised to play an even greater role in advancing fields such as medicine, materials science, and environmental technology.

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