Cas no 724742-87-4 (4-methyl-3,5-bis(4-methylphenyl)-1H-pyrazole)

4-Methyl-3,5-bis(4-methylphenyl)-1H-pyrazole is a substituted pyrazole derivative characterized by its aromatic methylphenyl groups at the 3- and 5-positions. This compound exhibits structural rigidity and enhanced lipophilicity due to its aromatic substituents, making it a valuable intermediate in organic synthesis and medicinal chemistry. Its well-defined molecular architecture allows for precise functionalization, facilitating applications in heterocyclic chemistry and ligand design. The presence of methyl groups on the phenyl rings may improve solubility in organic solvents while maintaining stability under standard conditions. This compound is particularly useful in the development of pharmacologically active scaffolds or as a building block for advanced materials research.
4-methyl-3,5-bis(4-methylphenyl)-1H-pyrazole structure
724742-87-4 structure
Product Name:4-methyl-3,5-bis(4-methylphenyl)-1H-pyrazole
CAS No:724742-87-4
MF:C18H18N2
MW:262.348924160004
MDL:MFCD05742175
CID:3059660
PubChem ID:852798
Update Time:2025-10-31

4-methyl-3,5-bis(4-methylphenyl)-1H-pyrazole Chemical and Physical Properties

Names and Identifiers

    • 4-Methyl-3,5-di-p-tolyl-1H-pyrazole
    • 4-methyl-3,5-bis(4-methylphenyl)-1H-pyrazole
    • STK349890
    • BBL040119
    • EN300-229986
    • AKOS000311457
    • AB01315913-02
    • NCGC00319454-01
    • CS-0281260
    • 724742-87-4
    • AR-360/42760749
    • MDL: MFCD05742175
    • Inchi: 1S/C18H18N2/c1-12-4-8-15(9-5-12)17-14(3)18(20-19-17)16-10-6-13(2)7-11-16/h4-11H,1-3H3,(H,19,20)
    • InChI Key: QWCJIVYSZDHDPM-UHFFFAOYSA-N
    • SMILES: N1C(C2C=CC(C)=CC=2)=C(C)C(C2C=CC(C)=CC=2)=N1

Computed Properties

  • Exact Mass: 262.146998583Da
  • Monoisotopic Mass: 262.146998583Da
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 20
  • Rotatable Bond Count: 2
  • Complexity: 301
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 4.6
  • Topological Polar Surface Area: 28.7?2

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4-methyl-3,5-bis(4-methylphenyl)-1H-pyrazole Related Literature

Additional information on 4-methyl-3,5-bis(4-methylphenyl)-1H-pyrazole

Comprehensive Overview of 4-methyl-3,5-bis(4-methylphenyl)-1H-pyrazole (CAS No. 724742-87-4)

The compound 4-methyl-3,5-bis(4-methylphenyl)-1H-pyrazole (CAS No. 724742-87-4) is a specialized organic molecule that has garnered significant attention in the fields of medicinal chemistry, material science, and agrochemical research. This pyrazole derivative is characterized by its unique structural features, including a central pyrazole ring substituted with methyl and 4-methylphenyl groups. Its molecular formula is C18H18N2, and it exhibits a molecular weight of 262.35 g/mol. The compound's distinct architecture makes it a valuable intermediate for synthesizing more complex molecules with potential applications in pharmaceuticals and advanced materials.

In recent years, the demand for heterocyclic compounds like 4-methyl-3,5-bis(4-methylphenyl)-1H-pyrazole has surged due to their versatility in drug discovery. Researchers are particularly interested in its role as a scaffold for kinase inhibitors, which are pivotal in treating cancers and inflammatory diseases. The compound's ability to modulate protein-protein interactions has also made it a subject of study in targeted therapy development. Additionally, its thermal stability and photophysical properties are being explored for applications in organic electronics, such as OLEDs and photovoltaic devices.

The synthesis of CAS No. 724742-87-4 typically involves multi-step organic reactions, including condensation and cyclization processes. One common method involves the reaction of 4-methylacetophenone with hydrazine derivatives under controlled conditions. The purity and yield of the final product are critical, as impurities can affect its performance in downstream applications. Advanced analytical techniques like HPLC, NMR spectroscopy, and mass spectrometry are employed to ensure quality control.

From an industrial perspective, 4-methyl-3,5-bis(4-methylphenyl)-1H-pyrazole is often utilized as a building block for high-value chemicals. Its derivatives are investigated for their potential as corrosion inhibitors in metal coatings, leveraging their ability to form protective films on surfaces. Moreover, the agrochemical sector explores its use in developing eco-friendly pesticides, aligning with the global shift toward sustainable farming practices.

Environmental and safety considerations are paramount when handling CAS No. 724742-87-4. While not classified as hazardous under standard regulations, proper storage conditions—such as avoiding prolonged exposure to light and moisture—are recommended to maintain stability. Researchers and manufacturers must adhere to Good Laboratory Practices (GLP) to minimize risks during handling and disposal.

The future prospects of 4-methyl-3,5-bis(4-methylphenyl)-1H-pyrazole are promising, with ongoing studies exploring its utility in nanotechnology and bioconjugation. For instance, its functional groups could enable covalent attachment to nanoparticles for drug delivery systems. As the scientific community continues to uncover its potential, this compound is poised to play a pivotal role in next-generation innovations across multiple disciplines.

In summary, CAS No. 724742-87-4 represents a fascinating intersection of chemistry and applied science. Its structural elegance and functional adaptability make it a cornerstone in modern research, addressing pressing challenges in health, energy, and sustainability. For those seeking detailed technical data or collaboration opportunities, consulting peer-reviewed journals or patent databases is highly recommended.

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