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4-Benzyloxyphenylacetonitrile

    • Product Name 4-Benzyloxyphenylacetonitrile
    • Alias Benzyl 4-cyanophenyl ether
    • Einecs 221-991-3
    • 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
    VTB
    Specifications

    HS Code

    939466

    Chemical Name 4-Benzyloxyphenylacetonitrile
    Cas Number 4546-64-5
    Molecular Formula C15H13NO
    Molecular Weight 223.27
    Appearance White to off-white solid
    Melting Point 72-75°C
    Density 1.16 g/cm³ (estimated)
    Solubility Slightly soluble in water; soluble in organic solvents
    Purity Typically ≥98%
    Smiles N#CCc1ccc(OCC2=CC=CC=C2)cc1
    Inchi InChI=1S/C15H13NO/c16-11-10-13-6-8-14(9-7-13)17-12-15-4-2-1-3-5-15/h1-9H,10,12H2
    Storage Temperature Store at 2-8°C
    Synonyms 4-(Benzyloxy)phenylacetonitrile

    As an accredited 4-Benzyloxyphenylacetonitrile factory, we enforce strict quality protocols—every batch undergoes rigorous testing to ensure consistent efficacy and safety standards.

    Packing & Storage
    Packing Amber glass bottle containing 25 grams of 4-Benzyloxyphenylacetonitrile, labeled with product details, hazard information, and batch number.
    Shipping 4-Benzyloxyphenylacetonitrile is shipped in tightly sealed containers, protected from moisture and light. Packaging complies with chemical safety regulations to prevent leaks or contamination. The container is labeled with hazard and handling information. During transport, it is stored in a cool, dry place and handled by trained personnel according to material safety guidelines.
    Storage **4-Benzyloxyphenylacetonitrile** should be stored in a tightly sealed container, in a cool, dry, and well-ventilated area, away from direct sunlight and incompatible substances such as strong oxidizers. Keep the storage area free from moisture and ignition sources. Handle under nitrogen or inert gas if sensitive to air. Ensure appropriate labeling and restrict access to trained personnel only.
    Application of 4-Benzyloxyphenylacetonitrile

    Applications of 4-Benzyloxyphenylacetonitrile in Industrial Manufacturing

    4-Benzyloxyphenylacetonitrile serves as a specialized chemical intermediate in a range of industrial value chains. Its core utility lies in pharmaceutical synthesis, advanced agrochemical formulation, fine chemical processes, and electronic material development. We focus on core downstream segments where this material consistently demonstrates technical and regulatory relevance.

    1. Pharmaceutical Active Pharmaceutical Ingredient (API) Intermediates

    Pharmaceutical manufacturers use 4-Benzyloxyphenylacetonitrile as a key nitrile source in the synthesis of specialty benzylated intermediates for nonsteroidal anti-inflammatory drugs (NSAIDs) and antineoplastic agents. The compound generally enters the synthetic route during side-chain introduction via nucleophilic substitution or oxidative coupling. It supports construction of advanced intermediates compliant with strict regulatory standards for human medicines. Reaction parameters must support GMP batch traceability and impurity profiling, as residual levels of both the raw ingredient and its byproducts are strictly controlled at the purification stage.

    Industry compliance standards

    • ICH Q7 GMP for APIs
    • USP-NF (United States Pharmacopeia – National Formulary) for starting materials
    • EU EMA Guideline on the Chemistry of Active Substances
    • Chinese Pharmacopoeia General Chapter 0921

    Typical usage ratio

    • Batch charge: 0.8–1.1 molar equivalents relative to target API intermediate, depending on downstream yield optimization

    Downstream process integration

    • Used in intermediate step following aromatic substitution and before hydrolysis or reduction
    • Fed into closed reaction vessels under nitrogen with in-process monitoring of residual cyanide and benzyl-protecting group cleavage

    Final product types

    • NSAID semifinished APIs (e.g., naproxen-type molecules)
    • Targeted oncology drug synthetic building blocks
    • Advanced intermediates for peptide API side chains
    • Semi-synthetic pharmaceutical raw materials

    2. Agrochemical Intermediate Synthesis

    In agrochemical manufacturing, 4-Benzyloxyphenylacetonitrile functions in the preparation of select nitrile-containing herbicide and fungicide scaffolds. Process chemists incorporate the compound during root step coupling or as a precursor for heterocyclic ring closure. Final impurity control, especially for benzyl residues and incomplete conversion, is essential for compliance. Environmental safety authorities require thorough toxicological evaluation at every stage due to potential persistency.

    Industry compliance standards

    • FAO/WHO Specifications for Plant Protection Products
    • EU REACH Registration for intermediates
    • ISO 9001 Quality Management for chemical synthesis
    • OECD Guidelines for Testing of Chemicals

    Typical usage ratio

    • 0.6–1.4 equivalents per reaction step, adjusted according to target crop protection active structure and conversion rate

    Downstream process integration

    • Introduced post-aromatic halogenation for nucleophilic addition and ring assembly
    • Monitored via in-process HPLC for reaction endpoint and byproduct minimization

    Final product types

    • Precursor to selective systemic herbicides (benzyl-substituted anilines)
    • Non-triazole heterocycle fungicide intermediates
    • Custom pro-pesticide synthesis components
    • Seed treatment raw actives

    3. Liquid Crystal Monomer Synthesis for Electronic Materials

    Manufacturers in the electronic materials sector deploy 4-Benzyloxyphenylacetonitrile when building specialty monomers for liquid crystal displays (LCDs). The cyanophenyl functional group offers compatibility with high-purity coupling and oligomerization reactions. Engineers use controlled polymerization to ensure dielectric, viscosity, and alignment performance. Contamination by ionic residues and aromatic impurities is rigidly regulated per electronics-grade requirements.

    Industry compliance standards

    • IEC 61249-2-37 for electronic base materials
    • RoHS Directive (EU Restriction of Hazardous Substances)
    • ISO 9001 for electronic chemical manufacturing
    • SEMI C57-0708 for LCD chemical specifications

    Typical usage ratio

    • 5–18% by weight in monomer feedstock; rate depends on desired optical properties and polymer length

    Downstream process integration

    • Fed into condensation or Suzuki-Miyaura coupling during liquid crystal monomer chain elongation
    • Integrated with solvent-based purification and electronic-grade packaging

    Final product types

    • LC monomers for TFT-LCD displays
    • Negative dielectric anisotropy additives
    • High-performance OLED display components
    • Specialty photoalignment materials

    4. Advanced Fragrance Chemical Intermediate

    Producers of high-value fragrance molecules employ 4-Benzyloxyphenylacetonitrile as a structural contributor during synthetic routes for aromatic nitrile notes. The compound enables formation of complex benzyl ether motifs crucial for desired scent characteristics. Downstream systems require extensive deodorization, solvent purity management, and batch reproducibility, as residual nitriles may impact olfactory end-quality.

    Industry compliance standards

    • IFRA (International Fragrance Association) Standards and Amendments
    • REACH Annex XVII (restrictions on aromatic nitriles)
    • ISO 9001 for fragrance intermediate synthesis
    • GMP for cosmetic raw materials

    Typical usage ratio

    • 2.5–7.5% by weight in reaction mixture, based on target fragrance formula and conversion efficiency

    Downstream process integration

    • Added to batch reactors during etherification and oxidation sequence
    • Deodorized in vacuum distillation and filtered for purity certification

    Final product types

    • Specialty musk and amber base notes
    • Benzylated aromatic fragrance intermediates
    • Pure isolates for fine perfume blending
    • Performance fragrance additives for personal care
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