Cas no 51264-60-9 (2-Methyl-3'-nitro-1,1'-biphenyl)

2-Methyl-3'-nitro-1,1'-biphenyl is a biphenyl derivative characterized by a methyl group at the 2-position and a nitro group at the 3'-position. This compound is primarily utilized as an intermediate in organic synthesis, particularly in the development of pharmaceuticals, agrochemicals, and specialty materials. Its structure allows for further functionalization, making it valuable in cross-coupling reactions and other transformations. The nitro group enhances reactivity for subsequent reduction or substitution, while the methyl group can influence steric and electronic properties. The compound is typically handled under controlled conditions due to its potential sensitivity. Its purity and stability are critical for consistent performance in synthetic applications.
2-Methyl-3'-nitro-1,1'-biphenyl structure
51264-60-9 structure
Product Name:2-Methyl-3'-nitro-1,1'-biphenyl
CAS No:51264-60-9
MF:C13H11NO2
MW:213.231943368912
MDL:MFCD03934885
CID:1025051
PubChem ID:4463174
Update Time:2025-05-24

2-Methyl-3'-nitro-1,1'-biphenyl Chemical and Physical Properties

Names and Identifiers

    • 2-Methyl-3'-nitro-1,1'-biphenyl
    • 1-methyl-2-(3-nitrophenyl)benzene
    • SCHEMBL5849628
    • BCA26460
    • MFCD03934885
    • DTXSID00403552
    • 2-Methyl-3'-nitrobiphenyl
    • 51264-60-9
    • AKOS015999280
    • A871329
    • CS-0204745
    • BS-28836
    • MDL: MFCD03934885
    • Inchi: 1S/C13H11NO2/c1-10-5-2-3-8-13(10)11-6-4-7-12(9-11)14(15)16/h2-9H,1H3
    • InChI Key: FLOWAYYOKMXTAH-UHFFFAOYSA-N
    • SMILES: [O-][N+](C1=CC=CC(=C1)C1C=CC=CC=1C)=O

Computed Properties

  • Exact Mass: 213.07900
  • Monoisotopic Mass: 213.078978594g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 0
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 2
  • Complexity: 249
  • 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: 4.2
  • Topological Polar Surface Area: 45.8?2

Experimental Properties

  • PSA: 45.82000
  • LogP: 4.09340

2-Methyl-3'-nitro-1,1'-biphenyl Customs Data

  • HS CODE:2904209090
  • Customs Data:

    China Customs Code:

    2904209090

    Overview:

    2904209090 Other derivatives containing only nitro or nitroso groups.Regulatory conditions:nothing.VAT:17.0%.Tax refund rate:9.0%.MFN tariff:5.5%.general tariff:30.0%

    Declaration elements:

    Product Name, component content, use to

    Summary:

    2904209090 derivatives containing only nitro or only nitroso groups.Supervision conditions:None.VAT:17.0%.Tax rebate rate:9.0%.MFN tariff:5.5%.General tariff:30.0%

2-Methyl-3'-nitro-1,1'-biphenyl Pricemore >>

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2-Methyl-3'-nitro-1,1'-biphenyl Production Method

Additional information on 2-Methyl-3'-nitro-1,1'-biphenyl

Comprehensive Overview of 2-Methyl-3'-nitro-1,1'-biphenyl (CAS No. 51264-60-9): Properties, Applications, and Industry Insights

2-Methyl-3'-nitro-1,1'-biphenyl (CAS No. 51264-60-9) is an organic compound belonging to the nitroaromatic biphenyl family. This compound has garnered significant attention in recent years due to its versatile applications in pharmaceuticals, agrochemicals, and material science. With the increasing demand for specialty chemicals in research and industrial sectors, understanding the properties and potential of 2-Methyl-3'-nitro-1,1'-biphenyl is crucial for scientists and manufacturers alike.

The molecular structure of 2-Methyl-3'-nitro-1,1'-biphenyl features a biphenyl backbone with a methyl group at the 2-position and a nitro group at the 3'-position. This unique arrangement contributes to its chemical reactivity, making it a valuable intermediate in organic synthesis. Researchers often explore its role in cross-coupling reactions, a topic frequently searched in academic databases and AI-driven platforms like ChatGPT. The compound's stability under various conditions also makes it a candidate for advanced material development, aligning with the growing interest in sustainable chemistry and green synthesis methods.

In the pharmaceutical industry, 2-Methyl-3'-nitro-1,1'-biphenyl serves as a precursor for the synthesis of bioactive molecules. Its nitro group can be reduced to an amine, enabling the creation of derivatives with potential therapeutic properties. This aligns with the trending focus on drug discovery and precision medicine, topics dominating scientific forums and search engine queries. Additionally, the compound's aromaticity and electron-withdrawing characteristics are exploited in designing fluorescent probes and organic semiconductors, addressing the surge in demand for optoelectronic materials.

From an industrial perspective, 2-Methyl-3'-nitro-1,1'-biphenyl is often discussed in the context of scalable synthesis and process optimization. Companies and researchers frequently search for cost-effective production methods and catalytic systems to enhance yield and purity. The compound's compatibility with palladium-catalyzed reactions and microwave-assisted synthesis further positions it as a subject of innovation in industrial chemistry.

Environmental and safety considerations are also critical when handling 2-Methyl-3'-nitro-1,1'-biphenyl. While not classified as a hazardous material, proper storage and handling protocols are essential to ensure workplace safety. This resonates with the increasing public interest in chemical safety data sheets (SDS) and regulatory compliance, as evidenced by search trends on platforms like Google Scholar and regulatory agency websites.

In summary, 2-Methyl-3'-nitro-1,1'-biphenyl (CAS No. 51264-60-9) is a multifaceted compound with broad applications in research and industry. Its relevance to cutting-edge technologies and sustainable practices ensures its continued prominence in scientific literature and commercial discussions. As the demand for high-performance chemicals grows, this compound will likely remain a focal point for innovation and exploration.

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