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3-Trifluoromethylbenzylcyanide

    • Product Name 3-Trifluoromethylbenzylcyanide
    • Alias 3-(Trifluoromethyl)phenylacetonitrile
    • Einecs 245-362-3
    • 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

    220662

    Chemicalname 3-Trifluoromethylbenzylcyanide
    Casnumber 402-54-0
    Molecularformula C9H6F3N
    Molecularweight 185.15
    Appearance Colorless to pale yellow liquid
    Boilingpoint 218-220°C
    Meltingpoint -10°C
    Density 1.21 g/cm3
    Purity Typically ≥ 98%
    Refractiveindex 1.489
    Flashpoint 89°C
    Synonyms α-Cyano-(m-trifluoromethyl)toluene
    Solubility Insoluble in water; soluble in organic solvents
    Smiles N#CCc1cccc(C(F)(F)F)c1
    Inchikey ZGVYSVPXGGMQDG-UHFFFAOYSA-N

    As an accredited 3-Trifluoromethylbenzylcyanide factory, we enforce strict quality protocols—every batch undergoes rigorous testing to ensure consistent efficacy and safety standards.

    Packing & Storage
    Packing Amber glass bottle, 100 grams; tightly sealed with a screw cap, labeled with chemical name, hazard pictograms, and safety handling instructions.
    Shipping 3-Trifluoromethylbenzylcyanide is shipped as a chemical substance requiring careful handling. It should be packed in tightly sealed containers, protected from moisture and incompatible materials. Shipping must comply with relevant hazardous materials regulations, including appropriate labeling, documentation, and, if necessary, temperature controls to prevent decomposition or release of toxic fumes during transit.
    Storage 3-Trifluoromethylbenzylcyanide should be stored in a tightly sealed container in a cool, dry, and well-ventilated area, away from heat sources, open flames, and incompatible substances such as strong oxidizing or reducing agents. Protect from direct sunlight and moisture. Use suitable secondary containment and clearly label the storage container. Always follow applicable local, state, and federal regulations for hazardous chemicals.
    Application of 3-Trifluoromethylbenzylcyanide

    Applications of 3-Trifluoromethylbenzylcyanide in Industrial Manufacturing

    As a specialized manufacturer of 3-Trifluoromethylbenzylcyanide, our focus lies in its established and high-value roles across key chemical synthesis industries. Below we outline real-world downstream applications and their technical integration in industrial-scale production environments.

    1. Pharmaceutical Intermediate Synthesis

    3-Trifluoromethylbenzylcyanide is widely used as a core building block in the synthesis of select pharmaceuticals, particularly those incorporating trifluoromethyl-substituted aromatic skeletons, such as certain antihypertensive agents and CNS-active compounds. Manufacturing processes integrate this intermediate into stepwise synthetic routes involving nucleophilic substitution, hydrolysis or reduction reactions that construct the final active ingredient. Production sites must meet stringent regulatory requirements from early-stage handling through to final product purification.

    Industry compliance standards

    • ICH Q7 Good Manufacturing Practice Guide for Active Pharmaceutical Ingredients
    • US FDA 21 CFR Part 211 (Current Good Manufacturing Practice for Finished Pharmaceuticals)
    • EU GMP Guidelines Volume 4
    • Relevant regional pharmacopoeias (e.g., USP, Ph. Eur.) for final APIs

    Typical usage ratio

    • Batch reaction input: 0.8–1.2 stoichiometric equivalents, adjusted based on specific reaction route and target molecule structure.

    Downstream process integration

    • Charged during initial coupling, condensation or alkylation steps of multi-step pharmaceutical syntheses, followed by further transformation (e.g., reduction, hydrolysis) and purification under GMP.

    Final product types

    • Active pharmaceutical ingredients (APIs) such as CNS drugs and antihypertensive agents featuring a trifluoromethylphenyl moiety

    2. Agrochemical Active Compound Manufacturing

    This raw material is integrated as a critical precursor in the manufacture of certain crop protection actives, especially insecticides and fungicides, where the trifluoromethylbenzyl motif imparts enhanced activity and environmental stability. Agrochemical producers employ custom synthetic routes leveraging its reactivity for the introduction of the cyanide function, followed by post-functionalization steps under controlled conditions to ensure compliance with agrochemical registration requirements.

    Industry compliance standards

    • Food and Agriculture Organization (FAO) and World Health Organization (WHO) Specifications for Plant Protection Products
    • OECD Good Laboratory Practice (GLP) for agrochemical active manufacturing
    • ISO 9001:2015 for quality management in chemical synthesis operations
    • European Regulation (EC) No 1107/2009 concerning the placing of plant protection products on the market

    Typical usage ratio

    • Input ratio: 5–20% by weight of total reactants, optimized according to target molecule design and yield considerations.

    Downstream process integration

    • Introduced during primary formation of the active organic compound, often via nucleophilic aromatic substitution and subsequent post-cyanation or partial hydrogenation, prior to formulation and packaging.

    Final product types

    • Technical grade insecticides and fungicides with trifluoromethylbenzyl-derived actives

    3. Fine Chemical and Specialty Intermediate Synthesis

    3-Trifluoromethylbenzylcyanide is employed in the fine chemical sector as a key intermediate for specialty chemical production, including advanced monomers, ligands, and functional materials. Manufacturers rely on its unique substitution pattern for constructing specialty molecules where the presence of both a cyanide group and a trifluoromethylphenyl ring enables precise downstream derivatization in controlled flow chemistry or batch synthesis systems, providing critical differentiation in product functionality.

    Industry compliance standards

    • ISO 9001:2015 for quality management in fine chemical manufacturing
    • IEC 61511 (Functional safety – Safety instrumented systems for the process industry sector) where hazardous reactions are present
    • REACH Registration (EC No. 1907/2006) for import and manufacture within the EU

    Typical usage ratio

    • 100–500 g per kg of target specialty chemical, fine-tuned to molecular recipe and reactivity constraints.

    Downstream process integration

    • Employed in the preparation of specialty nitriles, amines, or functional aromatic compounds via controlled batch or flow synthesis, including in-line derivatization or cyclization steps.

    Final product types

    • Specialty additives for polymers, advanced ligands for catalysis, functionalized aromatics for electronic chemicals

    4. Custom Organic Synthesis and Contract Manufacturing

    Chemical contract manufacturing organizations (CMOs) source 3-Trifluoromethylbenzylcyanide for process intensification projects, including synthesis of proprietary R&D intermediates and kilogram-scale pilots. The raw material is integrated according to contract customer route designs, typically under tight documentation and change control, with full traceability to meet end-user or patent process requirements.

    Industry compliance standards

    • Custom manufacturing per client-specific compliance protocols, including ISO 9001:2015 and client audit requirements
    • For regulated intermediates: documentation per ICH Q7 and CFR Title 21 (section-specific as defined by client)

    Typical usage ratio

    • As dictated by custom synthetic schemes; common pilot scales range from 0.1 to 3 molar equivalents per reaction step.

    Downstream process integration

    • Charged inline with project-specific process steps (e.g., Grignard reactions, alkylation, condensation) under controlled conditions, tracked by digital batch records and process validation protocols.

    Final product types

    • Proprietary chemical intermediates, R&D pilot samples, registration batches for new active molecules
    Free Quote

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    Tel: +8615371019725

    Email: admin@sinochem-nanjing.com

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