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4-Fluoro-2-(Trifluoromethyl)Phenylacetonitrile

    • Product Name 4-Fluoro-2-(Trifluoromethyl)Phenylacetonitrile
    • Alias 4-F-2-CF3-Ph-CH2CN
    • Einecs 630-911-6
    • 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

    128443

    Product Name 4-Fluoro-2-(Trifluoromethyl)Phenylacetonitrile
    Cas Number 130370-10-4
    Molecular Formula C9H5F4N
    Molecular Weight 203.14 g/mol
    Appearance White to off-white solid
    Melting Point 48-51 °C
    Purity Typically ≥98%
    Smiles FC1=CC=C(C#N)C(C(F)(F)F)=C1
    Inchikey NIDIUALGVHTOHJ-UHFFFAOYSA-N
    Solubility Soluble in organic solvents (e.g., DMSO, dichloromethane)
    Storage Temperature 2-8 °C (Refrigerated)
    Synonyms 2-(Trifluoromethyl)-4-fluorobenzyl cyanide

    As an accredited 4-Fluoro-2-(Trifluoromethyl)Phenylacetonitrile factory, we enforce strict quality protocols—every batch undergoes rigorous testing to ensure consistent efficacy and safety standards.

    Packing & Storage
    Packing The 25g package is a sealed amber glass bottle, labeled with the chemical name, formula, hazards, supplier, and batch number.
    Shipping 4-Fluoro-2-(Trifluoromethyl)Phenylacetonitrile is shipped in sealed, chemical-resistant containers to prevent moisture and contamination. It is handled as a hazardous material, complying with all relevant regulations for transit, including labeling and documentation. The package should remain upright, away from heat sources, and be delivered by approved couriers specialized in chemical shipments.
    Storage Store 4-Fluoro-2-(trifluoromethyl)phenylacetonitrile in a tightly sealed container, protected from moisture and light, in a cool, dry, and well-ventilated area. Keep away from incompatible substances such as strong oxidizers and acids. Use secondary containment to prevent spills, and ensure that only trained personnel have access. Follow all relevant chemical storage regulations and safety protocols.
    Application of 4-Fluoro-2-(Trifluoromethyl)Phenylacetonitrile

    Applications of 4-Fluoro-2-(Trifluoromethyl)Phenylacetonitrile in Industrial Manufacturing

    As a direct manufacturer, we supply 4-Fluoro-2-(Trifluoromethyl)Phenylacetonitrile as a key chemical intermediate in precise synthetic processes across regulated downstream sectors. Below we detail its industrial application scenarios with a focus on technical process integration, regulatory frameworks, usage requirements, and resulting end products.

    1. Active Pharmaceutical Ingredient (API) Intermediate Synthesis

    Pharmaceutical companies incorporate this material as a fluorinated aromatic intermediate in multi-step API synthesis lines, particularly for developing anti-inflammatory and central nervous system (CNS) drugs. Its unique fluoro and trifluoromethyl functionalities facilitate medicinal chemistry diversification and enable late-stage nitrile functionalization. Quality assurance follows GMP protocols throughout the synthetic route, demanding rigorous input material traceability and impurity control. The intermediate integrates into early-stage coupling or ring-closure reactions, where reaction kinetics and yield depend on batch temperature and solvent management.

    Industry compliance standards

    • ICH Q7 Good Manufacturing Practice for APIs
    • United States Pharmacopoeia (USP) standards for intermediate purity
    • EU EudraLex Volume 4 – GMP Guidelines
    • China Pharmacopoeia (ChP) where applicable for local production

    Typical usage ratio

    • Reactant charge 0.2–0.5 molar equivalents per API batch, fine-tuned according to molar balance in synthesis protocol
    • Adjustments for desired regioselectivity or substitution in medicinal scaffold assembly

    Downstream process integration

    • Charged to the initial aromatic substitution or cross-coupling step
    • Monitored for conversion using HPLC until endpoint
    • Residual traces tested for in subsequent purification

    Final product types

    • Small molecule APIs for CNS and inflammatory therapies
    • Intermediate intermediates for analgesic agents
    • Pre-cursors for select oncology compound series

    2. Crop Protection Active Ingredient Manufacturing

    Agrochemical formulators utilize the material as a functionalized precursor for synthesizing heterocyclic compounds with bioactivity against weeds, pests, and fungi. Its electron-withdrawing groups improve biological target binding and environmental stability. Process engineers introduce this nitrile compound in key condensation or cyclization steps, closely monitoring reaction purity in accordance with pesticide ingredient regulations. Compliance extends from pilot through commercial scale, with specific attestation during registration of technical and formulated crop protection products.

    Industry compliance standards

    • FAO/WHO specifications for pesticide technical materials
    • OECD Principles of Good Laboratory Practice (GLP) for intermediates
    • REACH registration for EU agrochemical intermediates
    • FIFRA (US EPA) for substances used in pesticide synthesis

    Typical usage ratio

    • 0.1–0.3 weight percent relative to total batch size, adjusted based on target heterocycle yield
    • Reaction scale-up may reduce ratio but requires validation per batch

    Downstream process integration

    • Introduced in amination, ring-closing, or substitution stages for active molecule assembly
    • Integration with continuous flow or batch reactors depending on process configuration
    • End-process residual determinations required for regulatory filings

    Final product types

    • Technical grade herbicides
    • Fungicidal active ingredients
    • Pre-emergent or selective post-emergent pesticides

    3. Advanced Material Synthesis for Electronic Chemicals

    Producers of specialty electronic chemicals deploy the compound as a functional group carrier in the synthesis of liquid crystal molecules and other display-related substrates. The fluorinated structure enhances dielectric properties and stability under electrical fields, which are critical in flat panel or OLED display manufacturing. Specialist technicians handle this compound under strict contamination control within ISO class production suites, emphasizing lot traceability and compatibility checks with downstream sensitizers or carrier matrices. Integration occurs during aryl nitrile coupling or precursor formulation before polymerization steps.

    Industry compliance standards

    • IEC 61249 and RoHS substance directives for electronic chemical safety
    • SEMI S2 standard for chemical handling in semiconductor and display processes
    • ISO 9001:2015 for quality management of functional raw materials
    • Internal material qualification protocols for high-purity fluorinated compounds

    Typical usage ratio

    • Used at 0.5–2 weight percent in individual display chemical batches
    • Adjusted for molecular alignment, mobility, and dielectric constant targets per customer spec

    Downstream process integration

    • Fed at early phase of arylation for core structure synthesis
    • Subjected to multiple purification cycles before integration with display active layers
    • Final QC includes LC-MS analysis for residue and purity mapping

    Final product types

    • Liquid crystal intermediates for TFT and OLED screens
    • Photoalignment materials for advanced panel displays
    • Specialty polymers for electro-optical applications

    4. Fine Chemical Intermediate in Dyes and Pigments

    Colorant factories use this nitrile-bearing compound to synthesize high-performance dyes and pigment precursors, especially where fluorinated aromatic cores impart enhanced colorfastness and resistance in textile and plastic applications. Reaction chemists introduce it in Suzuki or Buchwald-Hartwig couplings, carefully optimizing catalyst loading and solvent systems to maximize conversion and minimize secondary coloration or decomposition. Production runs require comprehensive batch documentation for downstream application approval by global textile and plastics customers.

    Industry compliance standards

    • Oeko-Tex Standard 100 for restricted substances in colorants
    • ISO 9001:2015 manufacturing quality systems
    • REACH Annex XVII compliance for pigment and dye intermediates
    • ZDHC MRSL guidelines for input chemicals

    Typical usage ratio

    • 0.2–0.8 molar equivalents per batch run of targeted chromophore
    • Modified according to dye strength, substrate compatibility, and final application requirements

    Downstream process integration

    • Charged in the arylation or nucleophilic addition stage for dye molecule assembly
    • Requires thorough washing and isolation post-reaction to prevent shade variance
    • Colorimetric QC analysis before transfer to finishing or formulation units

    Final product types

    • High-stability textile dyes
    • Performance pigments for plastics and coatings
    • Specialty colors for inkjet and security printing

    5. Intermediate for Specialty Organic Synthesis

    Contract manufacturing organizations and fine chemical houses employ the compound as an electron-withdrawing group source for synthesizing tailor-made building blocks. These intermediates supply downstream users in agrochemical, pharma, and specialty polymer sectors. Labs validate process reproducibility at kilo to ton scale and establish impurity profiles to meet customer-specific technical agreements and NDA requirements. Process chemists integrate the intermediate into Grignard additions or nucleophilic substitutions depending on the targeted final skeleton, following rigorous batch release and analytical verification.

    Industry compliance standards

    • ISO 9001:2015 for organizational quality management
    • Responsible Care (industry initiative for chemical producers)
    • Regulatory filings aligned with downstream customer jurisdictions (such as EU REACH)
    • SCCS opinion guidance if used in cosmetic intermediates

    Typical usage ratio

    • 0.05–0.3 molar ratio per target intermediate; ratio optimized by desired substitution pattern
    • Adjusted depending on process throughput and impurity limits agreed with the end-user

    Downstream process integration

    • Added during Grignard or nucleophilic substitution phase
    • Inline monitoring for completion using GC or NMR
    • Post-reaction, isolated and purified prior to customer shipment

    Final product types

    • Polyaromatic intermediates for specialty polymer synthesis
    • High-purity fine chemicals for research and development
    • Precursor blocks for custom synthesis contracts
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