Cas no 1017778-56-1 (3,6-dichloro-2-fluoro-aniline)

3,6-Dichloro-2-fluoro-aniline is a halogenated aniline derivative with significant utility in organic synthesis and agrochemical applications. Its distinct substitution pattern—featuring chloro and fluoro groups at the 3, 6, and 2 positions—enhances reactivity and selectivity in cross-coupling reactions, making it a valuable intermediate for pharmaceuticals and crop protection chemicals. The electron-withdrawing effects of the halogens improve its stability and facilitate further functionalization. This compound is particularly useful in the synthesis of advanced heterocyclic compounds and active ingredients requiring precise halogen placement. High purity grades ensure consistent performance in demanding synthetic processes. Proper handling is advised due to its potential toxicity and sensitivity to moisture.
3,6-dichloro-2-fluoro-aniline structure
3,6-dichloro-2-fluoro-aniline structure
Product Name:3,6-dichloro-2-fluoro-aniline
CAS No:1017778-56-1
MF:C6H4Cl2FN
MW:180.007062911987
MDL:MFCD09832331
CID:1134753
PubChem ID:46737655
Update Time:2025-08-04

3,6-dichloro-2-fluoro-aniline Chemical and Physical Properties

Names and Identifiers

    • 3,6-dichloro-2-fluoro-aniline
    • 3,6-Dichloro-2-fluoroaniline
    • 3,6-Dichloro-2-fluoroaniline,
    • AS-43957
    • 1017778-56-1
    • MFCD09832331
    • CS-0439793
    • AKOS006283189
    • 3,6-Dichloro-2-fluorobenzenamine
    • DTXSID501302624
    • MDL: MFCD09832331
    • Inchi: 1S/C6H4Cl2FN/c7-3-1-2-4(8)6(10)5(3)9/h1-2H,10H2
    • InChI Key: QNMHNBIMWNQSAL-UHFFFAOYSA-N
    • SMILES: ClC1=CC=C(C(=C1N)F)Cl

Computed Properties

  • Exact Mass: 178.9704827g/mol
  • Monoisotopic Mass: 178.9704827g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 10
  • Rotatable Bond Count: 0
  • Complexity: 122
  • 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: 2.6
  • Topological Polar Surface Area: 26?2

3,6-dichloro-2-fluoro-aniline Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
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AB264004-5 g
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Additional information on 3,6-dichloro-2-fluoro-aniline

3,6-Dichloro-2-Fluoro-Aniline: A Comprehensive Overview

The compound with CAS No. 1017778-56-1, commonly referred to as 3,6-dichloro-2-fluoro-aniline, is an aromatic amine derivative that has garnered significant attention in the fields of organic chemistry and materials science. This compound is characterized by its unique structure, which includes a benzene ring substituted with chlorine atoms at positions 3 and 6, and a fluorine atom at position 2. The presence of these halogen substituents imparts distinctive electronic and steric properties to the molecule, making it a valuable compound in various chemical applications.

3,6-Dichloro-2-fluoro-aniline has been extensively studied for its potential in synthesizing advanced materials. Recent research has highlighted its role as an intermediate in the preparation of novel polymers and high-performance composites. For instance, studies have demonstrated that this compound can be used as a building block for the synthesis of polyaromatic compounds with enhanced thermal stability and mechanical strength. These findings underscore the importance of 3,6-dichloro-2-fluoro-aniline in advancing materials science.

In addition to its role in materials synthesis, 3,6-dichloro-2-fluoro-aniline has also been explored for its applications in pharmaceutical chemistry. The compound's unique electronic properties make it a promising candidate for drug design, particularly in the development of bioactive molecules with specific pharmacokinetic profiles. Recent studies have investigated its potential as a precursor for synthesizing compounds with anti-inflammatory and anticancer activities.

The synthesis of 3,6-dichloro-2-fluoro-aniline involves a multi-step process that typically begins with the chlorination of aniline derivatives. The introduction of fluorine at position 2 requires precise control over reaction conditions to ensure high yields and purity. Researchers have recently developed more efficient synthetic routes that utilize catalytic systems to minimize waste and improve scalability. These advancements have made the production of 3,6-dichloro-2-fluoro-aniline more accessible for both academic and industrial applications.

From an environmental perspective, the ecological impact of 3,6-dichloro-2-fluoro-aniline has been a topic of interest. Studies have shown that this compound exhibits moderate biodegradability under aerobic conditions, which is promising for its safe disposal in industrial settings. However, further research is needed to fully understand its long-term effects on ecosystems and human health.

Looking ahead, the demand for 3,6-dichloro-2-fluoro-aniline is expected to grow as new applications continue to emerge. Its versatility as both a chemical intermediate and a functional material component positions it as a key compound in the chemical industry. As researchers delve deeper into its properties and potential uses, 3,6-dichloro-2-fluoro-aniline is poised to play an increasingly important role in shaping future innovations across multiple disciplines.

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