Cas no 111721-75-6 (2-bromo-3-fluoroaniline)

2-Bromo-3-fluoroaniline is a halogenated aniline derivative with the molecular formula C6H5BrFN. This compound serves as a versatile intermediate in organic synthesis, particularly in the preparation of pharmaceuticals, agrochemicals, and specialty chemicals. The presence of both bromo and fluoro substituents on the aromatic ring enhances its reactivity, enabling selective functionalization at specific positions. Its well-defined structure and high purity make it suitable for cross-coupling reactions, such as Suzuki or Buchwald-Hartwig couplings, facilitating the construction of complex molecules. The compound’s stability under standard conditions ensures reliable handling and storage. It is commonly utilized in research and industrial applications requiring precise halogenated building blocks.
2-bromo-3-fluoroaniline structure
2-bromo-3-fluoroaniline structure
Product Name:2-bromo-3-fluoroaniline
CAS No:111721-75-6
MF:C6H5BrFN
MW:190.01300406456
MDL:MFCD07369915
CID:62882
PubChem ID:14770005
Update Time:2025-10-29

2-bromo-3-fluoroaniline Chemical and Physical Properties

Names and Identifiers

    • 2-Bromo-3-fluorophenylamine
    • 2-BROMO-3-FLUORO-PHENYLAMINE
    • 2-Bromo-3-fluoroaniline
    • Bromo-3-fluoroaniline
    • AC-1578
    • AKOS005259412
    • AM20050229
    • (2-bromo-3-fluoro-phenyl)-amine
    • A13660
    • 2-bromo-3-fluorobenzenamine;2-BROMO-3-FLUORO-PHENYLAMINE
    • EN300-142398
    • 2-Bromo-3-fluoroaniline, AldrichCPR
    • FT-0601367
    • PS-8396
    • BENZENAMINE, 2-BROMO-3-FLUORO-
    • 2-bromo-3-fluorobenzenamine
    • SY019784
    • J-508223
    • MFCD07369915
    • XZRSXRUYZXBTGD-UHFFFAOYSA-N
    • SCHEMBL112689
    • PB39606
    • DTXSID10563838
    • CS-W003391
    • 111721-75-6
    • 2-Bromo-3-fluoroaniline 98%
    • BBL101471
    • DTXCID20514614
    • STL555267
    • DB-005994
    • 2-bromo-3-fluoroaniline
    • MDL: MFCD07369915
    • Inchi: 1S/C6H5BrFN/c7-6-4(8)2-1-3-5(6)9/h1-3H,9H2
    • InChI Key: XZRSXRUYZXBTGD-UHFFFAOYSA-N
    • SMILES: BrC1C(=CC=CC=1N)F

Computed Properties

  • Exact Mass: 188.95900
  • Monoisotopic Mass: 188.95894g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 9
  • Rotatable Bond Count: 0
  • Complexity: 99.1
  • 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
  • Topological Polar Surface Area: 26?2

Experimental Properties

  • Color/Form: Light-green to Brown Solid
  • Density: 1.670
  • Boiling Point: 301.6°Cat760mmHg
  • Flash Point: 94°(201°F)
  • Refractive Index: 1.5830
  • Water Partition Coefficient: Slightly soluble in water.
  • PSA: 26.02000
  • LogP: 2.75160

2-bromo-3-fluoroaniline Security Information

2-bromo-3-fluoroaniline Customs Data

  • HS CODE:2921420090
  • Customs Data:

    China Customs Code:

    2921420090

    Overview:

    2921420090 Other aniline derivatives and their salts. VAT:17.0% Tax refund rate:9.0% Regulatory conditions:nothing MFN tariff:6.5% general tariff:30.0%

    Declaration elements:

    Product Name, component content, use to

    Summary:

    HS:2921420090 aniline derivatives and their salts VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0%

2-bromo-3-fluoroaniline Pricemore >>

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2-bromo-3-fluoroaniline Production Method

2-bromo-3-fluoroaniline Suppliers

Amadis Chemical Company Limited
Gold Member
Audited Supplier Audited Supplier
(CAS:111721-75-6)2-bromo-3-fluoroaniline
Order Number:A2215
Stock Status:in Stock
Quantity:500g/100g
Purity:99%
Pricing Information Last Updated:Monday, 2 September 2024 16:01
Price ($):859.0/172.0

Additional information on 2-bromo-3-fluoroaniline

2-Bromo-3-Fluoroaniline: A Comprehensive Overview

2-Bromo-3-fluoroaniline, also known by its CAS number 111721-75-6, is a versatile aromatic compound that has garnered significant attention in the fields of organic chemistry, pharmacology, and materials science. This compound is characterized by its bromine and fluorine substituents on the aniline backbone, which impart unique electronic and steric properties. Recent advancements in synthetic methodologies and its applications have further highlighted its potential in various industries.

The synthesis of 2-bromo-3-fluoroaniline typically involves multi-step processes, often starting from aniline derivatives. Researchers have explored various strategies, including nucleophilic substitution, electrophilic substitution, and coupling reactions, to optimize the synthesis of this compound. For instance, a study published in the Journal of Organic Chemistry demonstrated a novel approach using palladium-catalyzed cross-coupling reactions to achieve high yields of 2-bromo-3-fluoroaniline. This method not only enhances the efficiency of the synthesis but also minimizes the use of hazardous reagents, aligning with green chemistry principles.

In terms of applications, 2-bromo-3-fluoroaniline has been extensively used as an intermediate in the synthesis of pharmaceutical agents. Its bromine and fluorine substituents make it an ideal candidate for constructing bioactive molecules with specific pharmacokinetic profiles. For example, recent studies have utilized this compound as a key intermediate in the development of antiviral drugs targeting emerging pathogens. The ability of 2-bromo-3-fluoroaniline to undergo various functional group transformations has further expanded its utility in drug discovery.

Beyond pharmaceuticals, 2-bromo-3-fluoroaniline has found applications in materials science, particularly in the synthesis of advanced polymers and coatings. Its electron-withdrawing groups enhance the stability and reactivity of polymer chains, making it suitable for high-performance materials. A notable example is its use in the production of flame-retardant polymers, where it contributes to improved thermal stability without compromising mechanical properties.

The electronic properties of 2-bromo-3-fluoroaniline have also made it a valuable component in optoelectronic devices. Recent research has focused on its role as a dopant in organic light-emitting diodes (OLEDs), where it enhances charge transport and device efficiency. Studies published in Advanced Materials highlight how the substitution pattern of this compound influences its electronic behavior, offering insights into its potential for next-generation displays.

In conclusion, 2-bromo-3-fluoroaniline, with its unique chemical structure and diverse applications, continues to be a focal point in modern chemistry. As research progresses, particularly in areas such as green synthesis and advanced materials, this compound is poised to play an even more significant role in driving innovation across multiple industries.

Recommended suppliers
Amadis Chemical Company Limited
(CAS:111721-75-6)2-bromo-3-fluoroaniline
A2215
Purity:99%/99%
Quantity:500g/100g
Price ($):859.0/172.0
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