Cas no 1481-21-6 (2-Bromo-3,4,6-trifluoroaniline)

2-Bromo-3,4,6-trifluoroaniline is a halogenated aniline derivative featuring bromine and fluorine substituents on the aromatic ring. This compound is primarily utilized as a versatile intermediate in organic synthesis, particularly in the preparation of pharmaceuticals, agrochemicals, and specialty materials. The presence of both bromine and fluorine groups enhances its reactivity, enabling selective functionalization in cross-coupling reactions and nucleophilic substitutions. Its electron-deficient aromatic system makes it valuable for constructing complex heterocycles and fluorinated compounds. The trifluoro substitution pattern further contributes to its stability and lipophilicity, which is advantageous in medicinal chemistry applications. Proper handling is required due to its potential sensitivity to light and moisture.
2-Bromo-3,4,6-trifluoroaniline structure
1481-21-6 structure
Product Name:2-Bromo-3,4,6-trifluoroaniline
CAS No:1481-21-6
MF:C6H3BrF3N
MW:225.993931055069
MDL:MFCD00012370
CID:117733
PubChem ID:614898
Update Time:2025-11-02

2-Bromo-3,4,6-trifluoroaniline Chemical and Physical Properties

Names and Identifiers

    • Benzenamine,2-bromo-3,4,6-trifluoro-
    • 2-Bromo-3,4,6-trifluoroaniline
    • 2-Bromo-3,4,5-trifluoroaniline
    • 6-BROMO-2,4,5-TRIFLUOROANILINE
    • 2,4,5-TRIFLUORO-6-BROMOANILINE
    • 1481-21-6
    • 2-bromanyl-3,4,6-tris(fluoranyl)aniline
    • Benzenamine, 2-bromo-3,4,6-trifluoro-
    • AMY8686
    • DTXSID60346779
    • FT-0633589
    • MFCD00012370
    • SCHEMBL1269773
    • CS-0207307
    • AKOS007930489
    • A808738
    • DB-042916
    • DTXCID40297851
    • MDL: MFCD00012370
    • Inchi: 1S/C6H3BrF3N/c7-4-5(10)2(8)1-3(9)6(4)11/h1H,11H2
    • InChI Key: MRXOTDULAFLMDA-UHFFFAOYSA-N
    • SMILES: BrC1C(=C(C=C(C=1N)F)F)F

Computed Properties

  • Exact Mass: 224.94000
  • Monoisotopic Mass: 224.94010g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 11
  • Rotatable Bond Count: 0
  • Complexity: 146
  • 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: 2.2
  • Topological Polar Surface Area: 26?2

Experimental Properties

  • Density: 1.875±0.06 g/cm3 (20 oC 760 Torr),
  • Melting Point: 36.5-37.5 oC
  • Boiling Point: 212.2±35.0 oC (760 Torr),
  • Flash Point: 97.2±0.0 oC,
  • Refractive Index: 1.545
  • Solubility: Almost insoluble (0.088 g/l) (25 o C),
  • PSA: 26.02000
  • LogP: 3.02980

2-Bromo-3,4,6-trifluoroaniline Security Information

  • WGK Germany:3
  • Hazard Category Code: 36/37/38
  • Safety Instruction: S26; S36
  • Hazardous Material Identification: Xi
  • Risk Phrases:R36/37/38
  • HazardClass:IRRITANT

2-Bromo-3,4,6-trifluoroaniline 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%

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2-Bromo-3,4,6-trifluoroaniline Suppliers

Amadis Chemical Company Limited
Gold Member
Audited Supplier Audited Supplier
(CAS:1481-21-6)2-Bromo-3,4,6-trifluoroaniline
Order Number:A808738
Stock Status:in Stock
Quantity:100g
Purity:99%
Pricing Information Last Updated:Monday, 2 September 2024 16:06
Price ($):475.0

Additional information on 2-Bromo-3,4,6-trifluoroaniline

Comprehensive Guide to 2-Bromo-3,4,6-trifluoroaniline (CAS No. 1481-21-6): Properties, Applications, and Market Insights

2-Bromo-3,4,6-trifluoroaniline (CAS No. 1481-21-6) is a specialized halogenated aniline derivative with significant relevance in modern chemical research and industrial applications. This compound, characterized by its unique bromo- and trifluoro-substituted aromatic structure, serves as a crucial intermediate in the synthesis of advanced materials, pharmaceuticals, and agrochemicals. Its molecular formula, C6H3BrF3N, highlights the presence of electron-withdrawing groups, which influence its reactivity and applications.

The growing interest in fluorinated organic compounds has positioned 2-Bromo-3,4,6-trifluoroaniline as a key building block in drug discovery and material science. Researchers frequently search for "synthesis of bromo-trifluoroaniline derivatives" or "applications of halogenated anilines," reflecting its importance in developing novel therapeutics and functional materials. The compound's high thermal stability and compatibility with cross-coupling reactions make it invaluable for constructing complex molecular architectures.

In the pharmaceutical industry, 2-Bromo-3,4,6-trifluoroaniline is utilized to synthesize fluoroquinolone antibiotics and kinase inhibitors. Its electron-deficient aromatic ring enhances binding affinity to biological targets, a feature often explored in "drug design using fluorinated intermediates" studies. Additionally, agrochemical manufacturers leverage this compound to develop herbicides and pesticides with improved environmental persistence and selectivity.

The material science sector values 2-Bromo-3,4,6-trifluoroaniline for its role in producing liquid crystals and OLED materials. Searches like "fluorinated anilines for optoelectronics" underscore its contribution to high-performance displays and energy-efficient lighting. The compound's low polarizability and high oxidative stability are critical for enhancing device lifetimes.

Market trends indicate rising demand for 2-Bromo-3,4,6-trifluoroaniline, driven by advancements in green chemistry and sustainable synthesis methods. Queries such as "eco-friendly bromination techniques" reflect industry shifts toward minimizing hazardous byproducts. Regulatory compliance with REACH and FDA guidelines further shapes its commercial production, ensuring safety and environmental responsibility.

Analytical characterization of 2-Bromo-3,4,6-trifluoroaniline typically involves GC-MS, NMR spectroscopy, and HPLC, with researchers often seeking "spectral data for bromo-trifluoroaniline." Its distinctive 1H-NMR peaks (δ 6.8–7.2 ppm) and 19F-NMR shifts (δ -110 to -150 ppm) facilitate precise identification in complex mixtures.

Future prospects for 2-Bromo-3,4,6-trifluoroaniline include expanding its utility in catalysis and nanotechnology. Emerging searches like "nanoparticle functionalization with halogenated aromatics" hint at innovative applications in drug delivery and sensors. Collaborative efforts between academia and industry continue to unlock its potential, reinforcing its status as a versatile chemical intermediate.

Recommended suppliers
Amadis Chemical Company Limited
(CAS:1481-21-6)2-Bromo-3,4,6-trifluoroaniline
A808738
Purity:99%
Quantity:100g
Price ($):475.0
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