Cas no 49674-16-0 (3-amino-5-bromobenzonitrile)

3-Amino-5-bromobenzonitrile is a versatile aromatic compound featuring both amino and bromo functional groups on a benzonitrile scaffold. Its distinct structure makes it a valuable intermediate in organic synthesis, particularly in pharmaceutical and agrochemical applications. The presence of the electron-withdrawing cyano group and the electron-donating amino group allows for selective functionalization, enabling the synthesis of complex heterocycles and fine chemicals. The bromo substituent further enhances its utility in cross-coupling reactions, such as Suzuki or Buchwald-Hartwig couplings. This compound exhibits high purity and stability, ensuring reliable performance in demanding synthetic processes. Its well-defined reactivity profile makes it a preferred choice for researchers developing novel bioactive molecules.
3-amino-5-bromobenzonitrile structure
3-amino-5-bromobenzonitrile structure
Product Name:3-amino-5-bromobenzonitrile
CAS No:49674-16-0
MF:C7H5BrN2
MW:197.032000303268
MDL:MFCD11109874
CID:838832
Update Time:2025-05-20

3-amino-5-bromobenzonitrile Chemical and Physical Properties

Names and Identifiers

    • 5-Amino-3-bromobenzonitrile
    • 3-Amino-5-bromobenzonitrile
    • 3-Bromo-5-cyanoaniline
    • KSC497O3F
    • 3-Amino-5-bromo-benzonitrile
    • Benzonitrile, 3-amino-5-bromo-
    • HPIFDUDZTLRWBV-UHFFFAOYSA-N
    • WT1586
    • CK1043
    • OR63032
    • RP25498
    • AS02380
    • FCH2614999
    • RP25501
    • AX8163649
    • ST2411711
    • AB0030541
    • X2
    • 3-amino-5-bromobenzonitrile
    • MDL: MFCD11109874
    • Inchi: 1S/C7H5BrN2/c8-6-1-5(4-9)2-7(10)3-6/h1-3H,10H2
    • InChI Key: HPIFDUDZTLRWBV-UHFFFAOYSA-N
    • SMILES: BrC1C=C(C#N)C=C(C=1)N

Computed Properties

  • Exact Mass: 195.96400
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 10
  • Rotatable Bond Count: 0
  • Complexity: 160
  • Topological Polar Surface Area: 49.8

Experimental Properties

  • PSA: 49.81000
  • LogP: 2.48418

3-amino-5-bromobenzonitrile Customs Data

  • HS CODE:2926909090
  • Customs Data:

    China Customs Code:

    2926909090

    Overview:

    2926909090 Other nitrile based compounds. 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:2926909090 other nitrile-function compounds VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0%

3-amino-5-bromobenzonitrile Pricemore >>

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3-amino-5-bromobenzonitrile Production Method

3-amino-5-bromobenzonitrile Suppliers

Amadis Chemical Company Limited
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Audited Supplier Audited Supplier
(CAS:49674-16-0)3-amino-5-bromobenzonitrile
Order Number:A847106
Stock Status:in Stock
Quantity:25g/100g
Purity:99%
Pricing Information Last Updated:Friday, 30 August 2024 07:13
Price ($):275.0/909.0

Additional information on 3-amino-5-bromobenzonitrile

Recent Advances in the Study of 3-Amino-5-bromobenzonitrile (CAS: 49674-16-0) and Its Applications in Chemical Biology and Pharmaceutical Research

3-Amino-5-bromobenzonitrile (CAS: 49674-16-0) is a key intermediate in the synthesis of various bioactive molecules and pharmaceutical compounds. Recent studies have highlighted its significance in drug discovery, particularly in the development of kinase inhibitors and other therapeutic agents. This research briefing provides an overview of the latest findings related to this compound, focusing on its chemical properties, synthetic applications, and potential biological activities.

One of the most notable advancements in the study of 3-amino-5-bromobenzonitrile is its role as a building block for the synthesis of novel kinase inhibitors. Researchers have demonstrated that this compound can be efficiently functionalized to produce derivatives with high selectivity and potency against specific kinase targets. For instance, a 2023 study published in the Journal of Medicinal Chemistry reported the successful use of 3-amino-5-bromobenzonitrile in the development of a new class of EGFR inhibitors, showing promising results in preclinical models of non-small cell lung cancer.

In addition to its applications in kinase inhibitor development, 3-amino-5-bromobenzonitrile has also been explored as a precursor for the synthesis of fluorescent probes and imaging agents. A recent study in ACS Chemical Biology detailed the use of this compound in the design of turn-on fluorescent probes for detecting reactive oxygen species (ROS) in live cells. The probes exhibited high sensitivity and specificity, making them valuable tools for studying oxidative stress-related diseases.

From a synthetic chemistry perspective, researchers have developed innovative methods for the efficient and scalable production of 3-amino-5-bromobenzonitrile. A 2022 publication in Organic Process Research & Development described a novel catalytic system that significantly improves the yield and purity of this compound, addressing previous challenges in large-scale synthesis. This advancement is expected to facilitate its broader use in pharmaceutical manufacturing and research.

The biological activities of 3-amino-5-bromobenzonitrile derivatives have also been a focus of recent investigations. Several studies have reported that these compounds exhibit antimicrobial and anti-inflammatory properties, with potential applications in treating infectious diseases and chronic inflammatory conditions. For example, a 2023 paper in European Journal of Medicinal Chemistry identified a series of derivatives with potent activity against drug-resistant bacterial strains, suggesting their potential as novel antibiotics.

In conclusion, 3-amino-5-bromobenzonitrile (CAS: 49674-16-0) continues to be a versatile and valuable compound in chemical biology and pharmaceutical research. Its applications span from drug discovery to diagnostic tools, driven by ongoing innovations in synthetic chemistry and biological evaluation. Future research is likely to explore its potential in additional therapeutic areas, further solidifying its importance in the field.

Recommended suppliers
Amadis Chemical Company Limited
(CAS:49674-16-0)3-amino-5-bromobenzonitrile
A847106
Purity:99%/99%
Quantity:25g/100g
Price ($):275.0/909.0
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