Cas no 948717-18-8 (2,4-Difluoro-N-methylbenzamide)

2,4-Difluoro-N-methylbenzamide is a fluorinated aromatic amide compound with the molecular formula C?H?F?NO. Its key structural features include two fluorine substituents at the 2- and 4-positions of the benzene ring and an N-methyl amide functional group. This compound is valued in synthetic chemistry as a versatile intermediate for pharmaceuticals, agrochemicals, and specialty materials due to its electron-withdrawing fluorine atoms, which enhance reactivity and stability. The N-methyl group further improves solubility and metabolic resistance, making it useful in drug design. Its well-defined crystalline structure ensures consistent purity, facilitating precise applications in research and industrial processes.
2,4-Difluoro-N-methylbenzamide structure
948717-18-8 structure
Product Name:2,4-Difluoro-N-methylbenzamide
CAS No:948717-18-8
MF:C8H7F2NO
MW:171.144088983536
CID:2129122
PubChem ID:17683266
Update Time:2025-05-21

2,4-Difluoro-N-methylbenzamide Chemical and Physical Properties

Names and Identifiers

    • 2,4-difluoro-N-methylbenzamide
    • N-methyl-2,4-difluorobenzamide
    • XNBLEAGPKPYTCT-UHFFFAOYSA-N
    • Benzamide, 2,4-difluoro-N-methyl-
    • 2,4-Difluoro-N-methylbenzamide
    • Inchi: 1S/C8H7F2NO/c1-11-8(12)6-3-2-5(9)4-7(6)10/h2-4H,1H3,(H,11,12)
    • InChI Key: XNBLEAGPKPYTCT-UHFFFAOYSA-N
    • SMILES: FC1C=C(C=CC=1C(NC)=O)F

Computed Properties

  • Exact Mass: 171.04957017g/mol
  • Monoisotopic Mass: 171.04957017g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 1
  • Complexity: 174
  • 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
  • Topological Polar Surface Area: 29.1
  • XLogP3: 1.4

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Additional information on 2,4-Difluoro-N-methylbenzamide

2,4-Difluoro-N-methylbenzamide

The compound 2,4-Difluoro-N-methylbenzamide (CAS No: 948717-18-8) is a versatile organic chemical that has garnered significant attention in various scientific and industrial applications. This compound is characterized by its unique structure, which includes a benzene ring substituted with two fluorine atoms at the 2 and 4 positions and an N-methylamid group. The combination of these functional groups imparts distinctive chemical properties, making it a valuable molecule in research and development.

Recent studies have highlighted the potential of 2,4-Difluoro-N-methylbenzamide in the field of agrochemistry, particularly as a precursor for herbicides and fungicides. Its ability to inhibit specific enzymes involved in plant metabolism has been extensively explored, with researchers emphasizing its selectivity and efficacy in controlling invasive species without adversely affecting crop health. This makes it a promising candidate for sustainable agricultural practices.

In the pharmaceutical industry, 2,4-Difluoro-N-methylbenzamide has been investigated as a building block for drug development. Its structure allows for easy modification to target specific biological pathways. For instance, studies have shown that derivatives of this compound can modulate receptor activity, potentially leading to novel treatments for chronic diseases such as cancer and neurodegenerative disorders.

The synthesis of 2,4-Difluoro-N-methylbenzamide involves a multi-step process that typically begins with the fluorination of benzene derivatives followed by amidation. Recent advancements in catalytic methods have improved the efficiency and scalability of this synthesis, reducing production costs and environmental impact. These developments have made the compound more accessible for large-scale applications.

From an environmental perspective, understanding the fate and transport of 2,4-Difluoro-N-methylbenzamide in ecosystems is crucial. Research indicates that it undergoes rapid degradation under UV light and microbial action, minimizing its persistence in the environment. However, further studies are required to assess its long-term effects on soil health and aquatic organisms.

In conclusion, 2,4-Difluoro-N-methylbenzamide (CAS No: 948717-18-8) stands out as a significant molecule with wide-ranging applications across multiple industries. Its unique chemical properties, coupled with recent research advancements, position it as a key player in future innovations.

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