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5-Benzyloxyindole-3-Acetonitrile

    • Product Name 5-Benzyloxyindole-3-Acetonitrile
    • Alias 5-Benzyloxy-1H-indole-3-acetonitrile
    • Einecs 609-204-9
    • 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
    VTB
    Specifications

    HS Code

    264857

    Chemical Name 5-Benzyloxyindole-3-Acetonitrile
    Cas Number 96830-42-1
    Molecular Formula C17H12N2O
    Molecular Weight 260.29
    Appearance Off-white to light yellow solid
    Melting Point 117-121°C
    Solubility Soluble in DMSO, moderately soluble in ethanol
    Purity Typically ≥98%
    Storage Temperature 2-8°C
    Smiles N#CCC1=CNC2=CC(=CC=C12)OCC3=CC=CC=C3
    Inchikey BYLHKIGACPMHQV-UHFFFAOYSA-N

    As an accredited 5-Benzyloxyindole-3-Acetonitrile 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 10 grams of 5-Benzyloxyindole-3-Acetonitrile, factory-sealed with tamper-evident cap and clear labeling.
    Shipping 5-Benzyloxyindole-3-Acetonitrile is shipped in tightly sealed, chemical-resistant containers to prevent contamination and leakage. Packaging complies with relevant hazardous materials regulations. The shipment is labeled with hazard and handling instructions and accompanied by a Safety Data Sheet (SDS). Transport typically follows UN and IATA guidelines for chemical safety and security.
    Storage 5-Benzyloxyindole-3-acetonitrile should be stored in a tightly sealed container, protected from light, moisture, and incompatible substances. Keep at room temperature or as specified on the manufacturer's label, generally in a cool, dry, well-ventilated area. Ensure the chemical is clearly labeled, and access is restricted to trained personnel. Follow all standard laboratory safety protocols when handling and storing this compound.
    Application of 5-Benzyloxyindole-3-Acetonitrile

    Applications of 5-Benzyloxyindole-3-Acetonitrile in Industrial Manufacturing

    5-Benzyloxyindole-3-Acetonitrile serves as a key intermediate for complex organic synthesis in the chemical industry, particularly within pharmaceutical, agrochemical, and specialty chemical sectors. Our production process ensures high purity and batch-to-batch consistency, supporting reliable downstream integration in advanced manufacturing processes.

    1. Pharmaceutical API Synthesis – Indole Alkaloid Development

    Manufacturers use this compound in multistep syntheses for development of indole-based active pharmaceutical ingredients, including derivatives aligned with oncology and neurology applications. It acts as a primary starting material for constructing the core indole nucleus in final drug APIs, supporting structural modifications to improve molecular specificity. Purity, impurity profile, and traceability remain critical to regulatory acceptance during scale-up for commercial batches, especially for regulated drug substance pathways.

    Industry compliance standards

    • ICH Q7: Good Manufacturing Practice for Active Pharmaceutical Ingredients
    • USP/EP/JPC monographs for relevant APIs (e.g., indole derivatives)
    • FDA 21 CFR Part 211 for finished pharmaceuticals
    • EU GMP Part II (APIs)

    Typical usage ratio

    • 0.1–3.0 molar equivalents depending on the synthetic step; constant adjustment based on route optimization and yield

    Downstream process integration

    • Used as an initial or mid-stage reactant in indole scaffold formation within multi-kilo production lines
    • Enters via grignard, Suzuki couplings, or cyclization reactions, usually followed by protection and deprotection strategies

    Final product types

    • Small-molecule oncology agents
    • Serotonin receptor modulators
    • Antiviral indole derivatives
    • Advanced pharmaceutical intermediates (indole acetic acids, indole-based heterocycles)

    2. Agrochemical Active Ingredient Development

    Crop protection manufacturers employ 5-benzyloxyindole-3-acetonitrile as a building block for synthesizing indole-based herbicides, fungicides, and growth regulators. The compound supports construction of pesticidal backbones that deliver specificity and controlled environmental release. This application requires adherence to agrochemical safety, impurity limits, and controlled substance tracking to meet regulatory frameworks for both export and domestic formulation plants.

    Industry compliance standards

    • OECD Principles of Good Laboratory Practice (GLP) for synthetic route validation
    • FAO/WHO specifications for active ingredient purity and impurities
    • REACH Registration (EC No. 1907/2006) for EU supply chains
    • US EPA Pesticide Registration Standards

    Typical usage ratio

    • 10–35% w/w in upstream intermediate vessel; further dilution during formulation to target field application rates

    Downstream process integration

    • Introduced during active ingredient core assembly, preceding further functionalization (chlorination, nitration, alkylation steps)
    • Integrated with solubility modifiers during downstream microencapsulation or granulation prior to packaging

    Final product types

    • Herbicidal indole derivatives
    • Plant growth regulators (indole-3-acetic acid derivatives)
    • Seed coating actives
    • Formulated crop protection agents

    3. Chemical Research and Custom Synthesis Services

    CROs and custom synthesis laboratories purchase 5-benzyloxyindole-3-acetonitrile in kilo to multi-kilo batches to support advanced method development, SAR investigations, and construction of novel heterocycles. This use demands high documentation standards, traceability, and custom packaging tailored to the academic or contract research environment, enabling diverse downstream experimental and pre-commercial pathways.

    Industry compliance standards

    • ISO 9001:2015 for quality management in custom synthesis
    • GLP compliance for preclinical and investigative work
    • Local hazardous material handling and transport guidelines
    • Custom client-specific specification sheets

    Typical usage ratio

    • 0.05–0.5 molar equivalents per reaction; volume based on experimental design and scale-up requirements

    Downstream process integration

    • Delivered as a substrate for construction of small-molecule libraries, novel scafolds, and specialty fine chemicals during route scouting and process validation
    • Handled in research suites with analytical QC (HPLC, NMR) according to client protocol

    Final product types

    • Reference standards for pharmaceutical R&D
    • Drug candidate libraries
    • Process validation samples
    • Building blocks for patent-expiry molecules or competitive synthetic routes

    4. Specialty Dyes and Pigments Manufacturing

    In the specialty chemicals sector, companies utilize this intermediate to synthesize high-performance indole-based dyes and pigments for textile, electronic, and photographic applications. The raw material enters complex condensation or substitution chemistries requiring precise stoichiometry and process control, supporting end products valued for their colorfastness and spectral properties. Manufacturers must monitor raw material quality to minimize batch color deviations and maintain reproducibility at scale.

    Industry compliance standards

    • ISO 9001/14001 for quality and environmental management in pigment synthesis
    • Oeko-Tex Standard 100 for textiles applications
    • DIN EN 71-3 for migration of certain elements in finished pigments used in sensitive goods
    • Client-mandated impurity and residual solvent limits

    Typical usage ratio

    • 15–50% of total reactant mass, variable by type of dye and final pigment concentration

    Downstream process integration

    • Used as a precursor during condensation with aromatic aldehydes or electrophilic partners
    • Advanced stage integration with color-stabilizing agents prior to crystallization or slurry drying

    Final product types

    • Indole-based textile dyes
    • Electronic display pigments
    • Photographic chemical dyes
    • Colorfast specialty pigments for industrial inks
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