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2-Cyanophenylboronic Acid, Pinacol Ester

    • Product Name 2-Cyanophenylboronic Acid, Pinacol Ester
    • Alias 2-Cyanophenylboronic acid pinacol ester
    • Einecs 810-396-9
    • Mininmum Order 1 g
    • Factory Site Tengfei Creation Center,55 Jiangjun Avenue, Jiangning District,Nanjing
    • Price Inquiry admin@sinochem-nanjing.com
    • Manufacturer Sinochem Nanjing Corporation
    • CONTACT NOW
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    Specifications

    HS Code

    707475

    Product Name 2-Cyanophenylboronic Acid, Pinacol Ester
    Cas Number 145681-19-0
    Molecular Formula C13H16BNO2
    Molecular Weight 225.08
    Appearance White to off-white solid
    Melting Point 70-75°C
    Boiling Point No data available
    Solubility Soluble in organic solvents (e.g. DMSO, THF, dichloromethane)
    Purity Typically ≥97%
    Density 1.13 g/cm³ (approximate)
    Smiles B(C1=CC=CC=C1C#N)OC(C)(C)C
    Inchi InChI=1S/C13H16BNO2/c1-13(2,3)17-14(16)12-8-4-5-11(6-8)7-15/h4-6,16H,1-3H3
    Storage Condition Store at 2-8°C, protected from moisture
    Refractive Index No data available
    Flash Point >110°C (estimated)

    As an accredited 2-Cyanophenylboronic Acid, Pinacol Ester factory, we enforce strict quality protocols—every batch undergoes rigorous testing to ensure consistent efficacy and safety standards.

    Packing & Storage
    Packing The product comes in a 5g amber glass bottle with a secure screw cap, labeled "2-Cyanophenylboronic Acid, Pinacol Ester."
    Shipping 2-Cyanophenylboronic Acid, Pinacol Ester is shipped in tightly sealed containers, protected from moisture and light. It is handled as a hazardous material, following all relevant safety and regulatory guidelines. Temperature control and appropriate cushioning are used to ensure product stability and integrity during transit. Safety documentation accompanies each shipment.
    Storage 2-Cyanophenylboronic Acid, Pinacol Ester should be stored in a cool, dry, and well-ventilated area, away from sources of ignition and moisture. Keep the container tightly closed and protected from direct sunlight. Store under inert gas, such as nitrogen or argon, if possible, to prevent hydrolysis or oxidation. Follow all safety guidelines and consult the product’s Safety Data Sheet (SDS) for detailed instructions.
    Application of 2-Cyanophenylboronic Acid, Pinacol Ester

    Applications of 2-Cyanophenylboronic Acid, Pinacol Ester in Industrial Manufacturing

    As an established manufacturer, we supply 2-cyanophenylboronic acid, pinacol ester to advanced chemical industries with demonstrated downstream adoption in precision-driven synthesis. The following application scenarios illustrate real-world integration of this raw material in targeted industrial production environments, highlighting compliance requirements, formulation details, practical process entry points, and typical product outputs.

    1. Advanced Active Pharmaceutical Ingredient (API) Synthesis

    This compound serves as a key intermediate in constructing biphenyl or biaryl frameworks crucial to kinase inhibitors and CNS drug actives via Suzuki-Miyaura cross-coupling. It allows for direct cyanation and boronate functionality transfer, enabling rapid assembly of core structures required by leading oncology therapeutics. Facilities deploy this ester under automated batch or continuous-flow hydrogenation and functionalization protocols aligned to GMP environments.

    Industry compliance standards

    • US FDA 21 CFR Part 211 (Current Good Manufacturing Practice for Finished Pharmaceuticals)
    • ICH Q7 Good Manufacturing Practice for Active Pharmaceutical Ingredients
    • European Pharmacopoeia quality requirements
    • Chinese Pharmacopoeia (ChP) for APIs

    Typical usage ratio

    • 0.8–1.2 molar equivalents relative to aryl halide reactant; volume adjusted for reaction scale-up based on target batch output, substrate load, and catalyst system

    Downstream process integration

    • Introduced at the Suzuki coupling step after aryl halide activation and base pre-mix, prior to catalyst charging
    • Boronate ester hydrolysis occurs post-reaction, followed by direct API purification and crystallization

    Final product types

    • Small-molecule APIs for oral oncology drugs
    • Biaryl-type CNS active pharmaceutical ingredients
    • Custom contract pharmaceutical intermediates

    2. OLED Display Materials Manufacture

    Within organic light-emitting diode (OLED) materials production, processors utilize this compound to design electron transport layers and emitter precursors built on cyanobiphenyl moieties. The high boronate reactivity ensures controlled molecular extension, supporting critical color purity, stability, and electroluminescent performance criteria in device fabrication environments.

    Industry compliance standards

    • RoHS Directive 2011/65/EU (Restriction of Hazardous Substances)
    • IEC 62321 for chemical substance content in electronic components
    • ISO 9001:2015 Quality Management for manufacturing traceability
    • Customer-specific material qualification protocols

    Typical usage ratio

    • 10–18 wt.% as molecular precursor in OLED emitter blends; adjusted by emission performance endpoints and film thickness targets

    Downstream process integration

    • Introduced at the molecular design phase in the synthesis of emitter or transport layer molecules
    • Followed by purification, blending with hosts, and vapor deposition or inkjet printing onto substrates

    Final product types

    • OLED emitter molecules (cyanobiphenyl-based)
    • Electron transport layer compounds for display stacks
    • High-resolution color display panels for consumer electronics

    3. Agrochemical Active Intermediate Production

    Agrochemical manufacturers exploit this boronic ester in the modular assembly of active fungicidal and herbicidal scaffold compounds. The cyano group facilitates downstream functionalization for activity optimization against resistant weed and pathogen strains using transition-metal-catalyzed reactions. This process supports cost-effective and environmentally compliant synthesis in full-scale pilot or commercial settings.

    Industry compliance standards

    • FAO/WHO specifications for pesticide active ingredients
    • REACH registration and substance assessment (EC 1907/2006)
    • ISO 9001:2015 for agrochemical intermediate production
    • China National Standard GB/T 1604 for pesticide industrial products

    Typical usage ratio

    • 0.9–1.1 molar equivalency against halogenated aromatic precursor; fine-tuned by target molecule and process yield optimization protocols

    Downstream process integration

    • Charged during Suzuki coupling step in multi-step synthesis for final pesticide intermediate formation
    • Subsequent hydrolysis and modification for biological activity enhancement

    Final product types

    • Aryl-cyano substituted intermediates for fungicides
    • Synthetic building blocks for herbicide actives
    • Crop-protection agent intermediates for formulation

    4. Specialty Liquid Crystal Synthesis

    Specialty chemicals producers integrate this boronic ester as a building block in synthesizing biphenyl-type mesogens for advanced nematic liquid crystal formulations. The cyanophenyl group confers high dielectric anisotropy and thermal stability, meeting performance requirements for advanced TFT-LCD and high-contrast display segments, including medical and industrial monitoring panels.

    Industry compliance standards

    • IEC 60810 (Requirements for chemical components of LCDs)
    • SGS RoHS Certification for display chemicals
    • GB/T 22264 for liquid crystal materials (China National Standard)
    • ISO 14001:2015 for environmental management in specialty chemical production

    Typical usage ratio

    • 6–12 mol% within mixed mesogen synthesis batches; calculated according to molecular weight and desired dielectric properties

    Downstream process integration

    • Dosed in the key Suzuki coupling or direct arylation stage of biphenyl mesogen construction
    • Followed by pure compound isolation, stability testing, and blending in LC mixtures

    Final product types

    • High-anisotropy nematic liquid crystals
    • Specialty mesogens for TFT-LCD panels
    • Custom LC compounds for scientific instrumentation displays

    5. Custom Fine Chemical Intermediate for Advanced Materials

    Leading fine chemical producers deploy the pinacol ester in the targeted functionalization of aromatic systems for specialty polymers and advanced resins. Its cyano and boronate moieties allow specific functional group transfer in step-growth polymerizations and cross-coupling, supporting the production of heat-resistant materials for electronics encapsulation and chemical apparatus components.

    Industry compliance standards

    • UL 94 V-0 (Flame classification for polymers)
    • REACH substance registration for specialty monomers
    • ISO 9001:2015 for fine chemical manufacturing
    • ASTM D638 for polymer mechanical property evaluation

    Typical usage ratio

    • Variable, 0.5–2.0 molar equivalents per aromatic dihalide unit depending on target polymer chain length and functional density

    Downstream process integration

    • Reacted during pre-polymer synthesis after initial activation, prior to molecular weight build-up stages
    • Forms polymer backbones or side chains through catalytic coupling

    Final product types

    • Specialty engineering thermoplastics for electronics
    • Cross-linked epoxy resins for high-reliability applications
    • Chemically resistant coatings and encapsulants
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