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4-Fluoro-3-(Trifluoromethyl)Benzonitrile

    • Product Name 4-Fluoro-3-(Trifluoromethyl)Benzonitrile
    • Alias 4-Fluoro-3-(trifluoromethyl)benzonitrile
    • Einecs 235-947-0
    • 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

    733020

    CAS_Number 402-46-0
    Molecular_Formula C8H3F4N
    Molecular_Weight 189.11
    Appearance White to off-white solid
    Melting_Point 45-49°C
    Boiling_Point 185-187°C (at 760 mmHg)
    Density 1.38 g/cm³
    Purity ≥98%
    Solubility Soluble in organic solvents (e.g., DMSO, acetone)
    Flash_Point 73.9°C
    Synonyms 4-Fluoro-3-(trifluoromethyl)benzonitrile
    SMILES N#CC1=CC(=CC=C1F)C(F)(F)F
    InChI InChI=1S/C8H3F4N/c9-6-2-1-5(4-13)3-7(6)8(10,11)12
    Refractive_Index 1.465

    As an accredited 4-Fluoro-3-(Trifluoromethyl)Benzonitrile 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-Fluoro-3-(trifluoromethyl)benzonitrile, sealed with a screw cap and labeled for chemical use.
    Shipping 4-Fluoro-3-(Trifluoromethyl)Benzonitrile is shipped in sealed, chemical-resistant containers, clearly labeled per regulatory standards. It is transported as a hazardous material, with documentation and handling procedures to ensure safety. The package is protected to avoid exposure to moisture, heat, and incompatible substances during transit. Rapid delivery maintains product integrity.
    Storage 4-Fluoro-3-(trifluoromethyl)benzonitrile should be stored in a tightly sealed container, away from moisture and incompatible materials such as strong oxidizers. Keep it in a cool, dry, and well-ventilated area, preferably in a designated chemical storage cabinet. Protect from direct sunlight and sources of heat or ignition. Properly label the container to prevent accidental misuse or mixing.
    Application of 4-Fluoro-3-(Trifluoromethyl)Benzonitrile

    Applications of 4-Fluoro-3-(Trifluoromethyl)Benzonitrile in Industrial Manufacturing

    4-Fluoro-3-(Trifluoromethyl)Benzonitrile is a crucial intermediate utilized in multiple chemical synthesis sectors, where its unique structural features enable downstream manufacturers to achieve precise electronic and steric modifications in target molecules. Below, we present real-world application scenarios, formulated from direct production engagements, with a focus on compliance, formulation, process integration, and finished product types.

    1. Agrochemical Active Ingredient Synthesis

    Downstream agrochemical producers employ this aromatic nitrile as a key building block to introduce fluorinated groups into novel herbicide and pesticide actives. Its electron-withdrawing profile supports efficient coupling reactions that yield final molecules with increased metabolic stability in field applications. The compound typically enters the synthetic sequence via nucleophilic aromatic substitution or palladium-catalyzed coupling, allowing manufacturers to fine-tune bioactive scaffolds for selectivity and residual control in agricultural settings.

    Industry compliance standards

    • FAO/WHO Guidelines for Pesticide Specifications
    • ISO 17025 quality management for agrochemical testing
    • REACH Regulation (EC) No 1907/2006 for chemical substances registration in the EU
    • China National GB/T 20684 safety standards for pesticide intermediates

    Typical usage ratio

    • 5%–21% w/w as a core intermediate within the total synthesis, depending on target active molecule loading and desired functional density; actual proportion determined by stoichiometric needs during key coupling steps.

    Downstream process integration

    • Initial fluorinated aromatic ring assembly by nucleophilic substitution or Suzuki-Miyaura coupling
    • Followed by amidation or further functionalization towards target agrochemical frameworks
    • Participates in batch or continuous flow processes for high-volume manufacturing
    • Subject to post-synthetic purification and QC residue analysis before subsequent conversion

    Final product types

    • Selective systemic herbicides (e.g., fluorinated phenoxyherbicides)
    • Insecticide actives with fluoroaromatic backbones
    • Fungicidal intermediates for cereal crop protection
    • Integrated formulation additives for environmental stability

    2. Pharmaceutical Intermediate in API Manufacturing

    Advanced pharmaceutical manufacturers integrate this fluorinated benzonitrile into multi-step synthesis of active pharmaceutical ingredients (APIs), where its structure delivers enhanced target affinity and metabolic resistance. The material routinely serves as a late-stage intermediate or as a fragment in aromatic halogenation protocols, supporting the development of compounds for central nervous system, anti-inflammatory, or anti-infective therapies. GMP compliance and impurity control remain central throughout the synthetic pipeline.

    Industry compliance standards

    • ICH Q7 GMP for active pharmaceutical ingredient (API) production
    • European Pharmacopoeia (Ph. Eur.) monographs on organic synthesis intermediates
    • US FDA 21 CFR Part 211 for pharmaceutical manufacturing controls
    • Japanese Pharmacopoeia (JP) for residual solvent and impurity limits

    Typical usage ratio

    • 12%–36% molar basis in selected synthetic routes; dosage depends on API core ring substitution pattern and is adjusted by synthetic route modeling

    Downstream process integration

    • Enters late-stage API synthesis via aromatic functionalization
    • Involved in Grignard or organolithium additions for side chain diversification
    • Processed under cGMP conditions with monitored reaction kinetics
    • Downstream purification via column chromatography or crystallization before API isolation

    Final product types

    • Small molecule APIs for CNS disorder treatments
    • Fluorinated anti-inflammatory pharmaceuticals
    • Intermediate compounds for on-market anti-infectives
    • Custom intermediates for orphan drug synthesis pipelines

    3. Specialty Material for OLED Intermediate Synthesis

    The electronic properties of this compound are leveraged by downstream specialty chemical firms to prepare advanced intermediates in organic light-emitting diode (OLED) materials development. Its trifluoromethyl and cyano substituents facilitate increased electron mobility and stability in aromatic cores, critical to achieving high-efficiency, long-lifetime display and lighting components. The material often contributes to the assembly of customer-specific emissive or transport layer monomers.

    Industry compliance standards

    • RoHS Directive 2011/65/EU compliance for hazardous substances in electronics
    • IEC 61249-2-21 specification for halogen-free electronic materials
    • UL 94 standard for materials flammability ratings
    • ISO 9001:2015 certified quality management for electronic components

    Typical usage ratio

    • 3%–15% w/w in the aromatic precursor batch for emissive or electron-transport polymers; ratio tailored based on device layer architecture and end luminance targets

    Downstream process integration

    • Condensation and coupling as a para-fluorinated monomer in polymer backbones
    • Doping/intercalation into functional layers during spin-coating or vapor deposition stage
    • Integrated pre-polymerization with proprietary chromophore synthesis protocols
    • Materials undergo purity screening and electronic property validation prior to device fabrication

    Final product types

    • Blue and green OLED emissive layer monomers
    • Electron-transport layer additives for flat panel displays
    • Specialty photoresist intermediates
    • Performance-enhanced polymer bank materials

    4. Intermediate for Veterinary Drug Synthesis

    Producers of veterinary pharmaceuticals incorporate this nitrile derivative during the assembly of specialized fluorinated scaffolds, targeting improved metabolic stability in livestock and companion animal health products. The chemical enables late-stage cyclization and substitution steps in the elaboration of active veterinary agents, while strict impurity controls and process documentation ensure batch traceability from intermediate to final formulation.

    Industry compliance standards

    • VICH GL3 GMP for veterinary pharmaceutical manufacturing
    • European Pharmacopoeia (Ph. Eur.) vet-specific guidelines
    • US FDA CVM (Center for Veterinary Medicine) registration protocols
    • China Veterinary Pharmacopoeia monographs for veterinary APIs

    Typical usage ratio

    • 7%–18% molar percentage within total synthetic batch, determined by final fluorinated structural motif and required therapeutic loading

    Downstream process integration

    • Intermediate for aromatization or cyclization in late-stage veterinary API construction
    • Processed in multi-step syntheses including hydrogenation and halogenation
    • QC confirms removal of unreacted nitrile prior to final formulation blending
    • Traceability maintained with standardized batch records throughout production

    Final product types

    • Oral and injectable veterinary pharmaceuticals
    • Antiparasitic bulk drug substances
    • Livestock health intermediate APIs
    • Companion animal therapeutic actives

    5. Precursor in Fluorinated Polymer Synthesis

    Chemical manufacturers specializing in advanced fluoropolymers utilize the benzonitrile in the construction of pre-functionalized aromatic blocks that impart chemical resistance, thermal stability, and dielectric properties in specialty engineering polymers. Control of substitution patterns during condensation, polymerization, and cross-linking steps is critical to achieving the final polymer performance required in demanding industrial environments.

    Industry compliance standards

    • ASTM D5892 for fluoropolymer resin testing
    • UL 746B for polymeric materials in electrical applications
    • ISO 14001 for environmental management of chemical processing plants
    • REACH Annex XIV for fluorinated monomer use in EU markets

    Typical usage ratio

    • 2%–11% by molar substitution in the aromatic diad fraction prior to polymerization—ratio selected based on target polymer chain composition and achieved by adjusting the monomer feed in the pre-polymerization stage

    Downstream process integration

    • Undergoes controlled condensation with other di- or tri-functional monomers
    • Used as feedstock for step-growth polymerization pathways
    • Material is subjected to moisture and impurity testing before large-scale polymer synthesis
    • Post-polymerization, batch validation ensures fluorinated block integration as per customer technical specification

    Final product types

    • Fluorinated engineering plastics for electronics
    • Protective polymer coatings for chemical-resistant applications
    • High-performance dielectric films
    • Special structure–property relationship resins for industrial membranes
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