Cas no 1248209-18-8 (N-Ethyl-2,3-difluoro-6-nitroaniline)

N-Ethyl-2,3-difluoro-6-nitroaniline structure
1248209-18-8 structure
Product Name:N-Ethyl-2,3-difluoro-6-nitroaniline
CAS No:1248209-18-8
MF:C8H8F2N2O2
MW:202.158128738403
MDL:MFCD16787129
CID:1025204
PubChem ID:54759079
Update Time:2025-11-02

N-Ethyl-2,3-difluoro-6-nitroaniline Chemical and Physical Properties

Names and Identifiers

    • N-Ethyl-2,3-difluoro-6-nitroaniline
    • SB77127
    • DTXSID70716681
    • MFCD16787129
    • Benzenamine, N-ethyl-2,3-difluoro-6-nitro-
    • A890353
    • CS-0208701
    • BS-19642
    • 1248209-18-8
    • AKOS011824045
    • MDL: MFCD16787129
    • Inchi: 1S/C8H8F2N2O2/c1-2-11-8-6(12(13)14)4-3-5(9)7(8)10/h3-4,11H,2H2,1H3
    • InChI Key: OQZJPLHCMMMQOV-UHFFFAOYSA-N
    • SMILES: FC1=C(C=CC(=C1NCC)[N+](=O)[O-])F

Computed Properties

  • Exact Mass: 202.05500
  • Monoisotopic Mass: 202.05538383g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 3
  • Complexity: 210
  • 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: 2.9
  • Topological Polar Surface Area: 57.8?2

Experimental Properties

  • PSA: 57.85000
  • LogP: 2.90100

N-Ethyl-2,3-difluoro-6-nitroaniline Pricemore >>

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Additional information on N-Ethyl-2,3-difluoro-6-nitroaniline

Comprehensive Overview of N-Ethyl-2,3-difluoro-6-nitroaniline (CAS No. 1248209-18-8): Properties, Applications, and Industry Insights

N-Ethyl-2,3-difluoro-6-nitroaniline (CAS No. 1248209-18-8) is a specialized fluorinated nitroaniline derivative that has garnered significant attention in pharmaceutical and agrochemical research. This compound belongs to the class of nitroaromatic compounds, which are widely utilized as intermediates in the synthesis of more complex molecules. The presence of both fluoro and nitro functional groups in its structure enhances its reactivity, making it a valuable building block in organic synthesis.

In recent years, the demand for fluorinated organic compounds like N-Ethyl-2,3-difluoro-6-nitroaniline has surged due to their unique physicochemical properties. Fluorination often improves a compound's metabolic stability, lipophilicity, and bioavailability, which are critical factors in drug design. Researchers frequently search for "fluorinated aniline derivatives" or "nitroaniline applications" to explore their potential in developing new therapeutics. This compound's CAS number 1248209-18-8 is often referenced in patent literature and scientific databases, highlighting its relevance in cutting-edge research.

The synthesis of N-Ethyl-2,3-difluoro-6-nitroaniline typically involves multi-step reactions, starting from commercially available 2,3-difluoroaniline. The introduction of the nitro group and subsequent N-ethylation are key steps that require precise control to ensure high yield and purity. Analytical techniques such as HPLC, NMR, and mass spectrometry are employed to characterize this compound, ensuring it meets the stringent standards required for research and industrial applications.

One of the most searched topics related to this compound is its "role in medicinal chemistry." Fluorinated nitroanilines are often explored as precursors for heterocyclic compounds, which form the backbone of many FDA-approved drugs. For instance, they can be transformed into benzimidazoles or quinoxalines, structures commonly found in antiviral and anticancer agents. The "bioisosteric replacement" potential of fluorine atoms in drug design is another hot topic, as it can significantly alter a molecule's interaction with biological targets.

Beyond pharmaceuticals, N-Ethyl-2,3-difluoro-6-nitroaniline finds applications in material science. Its electron-withdrawing properties make it a candidate for designing organic semiconductors or photoactive materials. Researchers investigating "fluorinated materials for OLEDs" or "nitroaromatic compounds in electronics" may encounter this compound in their literature reviews. The growing interest in sustainable chemistry has also led to searches for "green synthesis of nitroanilines," emphasizing the need for eco-friendly production methods.

From a commercial perspective, suppliers and manufacturers often list CAS 1248209-18-8 under categories like "fine chemicals" or "research intermediates." The compound's pricing, purity grades (e.g., >98% HPLC), and packaging options (e.g., grams to kilograms) are frequently queried by procurement specialists. Regulatory compliance, such as REACH or GMP standards, is another critical consideration for buyers, especially in the European and North American markets.

In conclusion, N-Ethyl-2,3-difluoro-6-nitroaniline (CAS No. 1248209-18-8) represents a versatile and valuable compound in modern chemical research. Its applications span from drug discovery to advanced materials, aligning with industry trends toward fluorinated and functionalized aromatic systems. As scientific inquiries continue to evolve—whether in "structure-activity relationships" or "novel synthetic methodologies"—this compound will likely remain a subject of interest for researchers worldwide.

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