Cas no 1041593-26-3 (2-(2-Naphthyloxy)benzonitrile)

2-(2-Naphthyloxy)benzonitrile is a specialized organic compound featuring a naphthyloxy group linked to a benzonitrile core. This structure imparts unique electronic and steric properties, making it valuable as an intermediate in pharmaceutical and agrochemical synthesis. Its aromatic and polar characteristics enhance reactivity in cross-coupling reactions, facilitating the construction of complex molecular frameworks. The compound’s stability under various conditions allows for versatile applications in fine chemical manufacturing. Its well-defined structure ensures consistent performance in research and industrial settings, particularly in the development of advanced materials and bioactive molecules. High purity grades are available to meet stringent requirements for precision synthesis.
2-(2-Naphthyloxy)benzonitrile structure
2-(2-Naphthyloxy)benzonitrile structure
Product Name:2-(2-Naphthyloxy)benzonitrile
CAS No:1041593-26-3
MF:C17H11NO
MW:245.275344133377
MDL:MFCD12618618
CID:1056575
Update Time:2025-05-20

2-(2-Naphthyloxy)benzonitrile Chemical and Physical Properties

Names and Identifiers

    • 2-(Naphthalen-2-yloxy)benzonitrile
    • 2-(2-Naphthyloxy)benzonitrile
    • 2-(2-naphthalenyloxy)Benzonitrile
    • 2-naphthalen-2-yloxybenzonitrile
    • 5196AJ
    • SY013635
    • AX8280675
    • MDL: MFCD12618618
    • Inchi: 1S/C17H11NO/c18-12-15-7-3-4-8-17(15)19-16-10-9-13-5-1-2-6-14(13)11-16/h1-11H
    • InChI Key: QGWGXDZTSVIHTI-UHFFFAOYSA-N
    • SMILES: O(C1C=CC=CC=1C#N)C1=CC=C2C=CC=CC2=C1

Computed Properties

  • Exact Mass: 245.08400
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 19
  • Rotatable Bond Count: 2
  • Complexity: 344
  • Topological Polar Surface Area: 33

Experimental Properties

  • PSA: 33.02000
  • LogP: 4.50378

2-(2-Naphthyloxy)benzonitrile 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%

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2-(2-Naphthyloxy)benzonitrile Suppliers

Amadis Chemical Company Limited
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(CAS:1041593-26-3)2-(2-Naphthyloxy)benzonitrile
Order Number:A896275
Stock Status:in Stock
Quantity:5g
Purity:99%
Pricing Information Last Updated:Friday, 30 August 2024 11:54
Price ($):247.0

Additional information on 2-(2-Naphthyloxy)benzonitrile

2-(2-Naphthyloxy)benzonitrile: A Comprehensive Overview

The compound with CAS No. 1041593-26-3, commonly referred to as 2-(2-Naphthyloxy)benzonitrile, is a fascinating molecule that has garnered significant attention in the fields of organic chemistry, materials science, and pharmacology. This compound is characterized by its unique structure, which combines a naphthyl group with a benzonitrile moiety, making it a versatile building block for various applications. In this article, we will delve into the properties, synthesis, applications, and recent research findings related to 2-(2-Naphthyloxy)benzonitrile.

2-(2-Naphthyloxy)benzonitrile is an aromatic heterocyclic compound with a naphthyl group attached to a benzonitrile via an ether linkage. The naphthyl group contributes to the molecule's extended conjugation system, enhancing its electronic properties. This feature makes it particularly useful in the development of advanced materials such as organic semiconductors and light-emitting diodes (OLEDs). Recent studies have demonstrated that the compound exhibits excellent charge transport properties, making it a promising candidate for next-generation electronic devices.

The synthesis of 2-(2-Naphthyloxy)benzonitrile typically involves a multi-step process that includes nucleophilic substitution and coupling reactions. Researchers have explored various synthetic pathways to optimize the yield and purity of the compound. For instance, a study published in *Journal of Organic Chemistry* highlighted a novel approach using palladium-catalyzed cross-coupling reactions, which significantly improved the reaction efficiency. This advancement not only simplifies the synthesis process but also reduces the environmental impact associated with traditional methods.

In terms of applications, 2-(2-Naphthyloxy)benzonitrile has found its niche in the pharmaceutical industry. Its ability to act as a bioisostere in drug design has been extensively studied. A recent paper in *Nature Communications* reported that the compound can serve as a scaffold for developing new anticancer agents due to its ability to inhibit specific protein kinases involved in tumor progression. This discovery underscores the potential of 2-(2-Naphthyloxy)benzonitrile in drug discovery and development.

Moreover, 2-(2-Naphthyloxy)benzonitrile has shown promise in the field of materials science. Its high thermal stability and excellent optical properties make it an ideal candidate for use in organic photovoltaic (OPV) devices. A team of researchers at Stanford University demonstrated that incorporating this compound into OPV architectures significantly enhances light absorption and charge separation efficiency. These findings have opened new avenues for improving the efficiency and sustainability of solar energy technologies.

Recent advancements in computational chemistry have also shed light on the electronic structure of 2-(2-Naphthyloxy)benzonitrile. Density functional theory (DFT) calculations reveal that the molecule exhibits unique π-conjugation patterns, which contribute to its exceptional electronic properties. These insights are crucial for designing new materials with tailored functionalities for specific applications.

In conclusion, CAS No. 1041593-26-3, or 2-(2-Naphthyloxy)benzonitrile, is a versatile compound with a wide range of applications across multiple disciplines. From organic electronics to drug discovery, this molecule continues to be a focal point for researchers seeking innovative solutions. As ongoing studies uncover new properties and applications, 2-(2-Naphthyloxy)benzonitrile is poised to play an increasingly important role in advancing modern science and technology.

Recommended suppliers
Amadis Chemical Company Limited
(CAS:1041593-26-3)2-(2-Naphthyloxy)benzonitrile
A896275
Purity:99%
Quantity:5g
Price ($):247.0
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