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5-Methyl-1,3-Benzenediacetonitrile

    • Product Name 5-Methyl-1,3-Benzenediacetonitrile
    • Alias 5-Methyl-1,3-phenylenediacetonitrile
    • Einecs 405-040-4
    • 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

    121146

    Chemicalname 5-Methyl-1,3-Benzenediacetonitrile
    Casnumber 16411-09-7
    Molecularformula C11H10N2
    Molecularweight 170.21 g/mol
    Appearance White to off-white solid
    Meltingpoint 83-86°C
    Boilingpoint Unknown
    Solubility Slightly soluble in water; soluble in organic solvents
    Density 1.13 g/cm³ (estimated)
    Smiles CC1=CC(=CC(=C1)CC#N)CC#N
    Inchi InChI=1S/C11H10N2/c1-9-2-3-10(4-5-13)7-11(9)6-8-12/h2-3,7H,4,6H2,1H3
    Pubchemcid 11644872

    As an accredited 5-Methyl-1,3-Benzenediacetonitrile factory, we enforce strict quality protocols—every batch undergoes rigorous testing to ensure consistent efficacy and safety standards.

    Packing & Storage
    Packing Amber glass bottle with secure screw cap, labeled “5-Methyl-1,3-Benzenediacetonitrile, 50g,” including hazard symbols and handling instructions.
    Shipping 5-Methyl-1,3-Benzenediacetonitrile is shipped in tightly sealed containers, protected from moisture and direct sunlight. It should be packaged according to relevant regulations for hazardous chemicals, labeled properly, and handled with care to prevent leaks or spills. Ensure compliance with local, national, and international shipping laws for dangerous goods.
    Storage **5-Methyl-1,3-Benzenediacetonitrile** should be stored in a cool, dry, and well-ventilated area, away from heat sources and direct sunlight. Keep the container tightly closed when not in use. Store separately from incompatible materials such as strong oxidizers and acids. Ensure proper labeling and use chemical-resistant containers to prevent leaks or contamination.
    Application of 5-Methyl-1,3-Benzenediacetonitrile

    Applications of 5-Methyl-1,3-Benzenediacetonitrile in Industrial Manufacturing

    5-Methyl-1,3-Benzenediacetonitrile supports key downstream production chains as a specialized intermediate. As a direct manufacturer, we deliver high-purity material meeting diverse industry requirements for advanced synthesis, regulated processes, and controlled production environments.

    1. Pharmaceutical Intermediate for Antihypertensive Drug Synthesis

    5-Methyl-1,3-Benzenediacetonitrile serves as a critical building block for synthesizing pharmaceutical compounds, particularly in the production of certain antihypertensive agents within regulated API plants. Synthesis routes use this intermediate for key carbon–carbon bond formation, enabling the construction of substituted pyrimidines and heterocyclic scaffolds essential for modern cardiovascular medications. Close control of purity and impurity profiles ensures process repeatability, traceability, and compliance with regulatory dossiers.

    Industry compliance standards

    • ICH Q7 (Good Manufacturing Practice for Active Pharmaceutical Ingredients)
    • 21 CFR Part 211 (US FDA cGMP requirements for finished pharmaceuticals)
    • European Pharmacopoeia monographs for APIs
    • EMA/CHMP guidelines on elemental impurities and residual solvents

    Typical usage ratio

    • 0.2–0.8 molar equivalents as an intermediate, depending on the specific reaction step and target API yield
    • Ratio adjusted to compensate for yield losses in multistep synthesis and ensure downstream purity targets

    Downstream process integration

    • Introduced in early to mid-stage coupling reactions during API core structure assembly
    • Reacted under controlled temperature with protected nucleophiles and catalysts in closed-reactor systems
    • Subject to in-process QC for intermediate identification and impurity control

    Final product types

    • Active pharmaceutical ingredients for antihypertensives
    • Pyrimidine- and pyridine-based drug substances
    • Intermediates for finished cardiovascular formulations

    2. Agrochemical Intermediate for Herbicide Production

    Within agrochemical manufacturing, 5-Methyl-1,3-Benzenediacetonitrile enables the construction of complex aromatic systems used in selective herbicide molecules. Its reactive nitrile groups facilitate integration into synthesis routes for diaryl and arylalkyl herbicide backbones, contributing to desired crop selectivity. Consistent lot quality and trace impurity management help meet crop safety and residue standards enforced by global agricultural regulators.

    Industry compliance standards

    • FAO/WHO Specifications for Plant Protection Products
    • ISO 9001:2015 for industrial chemical quality management
    • REACH Regulation (EC) No 1907/2006 registration for raw material import
    • Guidelines for Maximum Residue Levels (MRLs) by EPA (USA), EFSA (EU)

    Typical usage ratio

    • 5–15% by mass in specific upstream herbicide synthesis steps
    • Dosing depends on specific molecular transformation and final active content

    Downstream process integration

    • Charged during initial nucleophilic substitution or condensation reactions
    • Participates in high-temperature batch processing using alkali or acid catalysts
    • Unreacted material and byproducts monitored via HPLC before downstream purification

    Final product types

    • Precursor compounds for selective herbicides
    • Active ingredients for post-emergence crop protection products
    • Herbicidal intermediates for industrial and agricultural formulations

    3. Dye and Pigment Intermediate in Specialty Chemicals

    Specialty dye producers use 5-Methyl-1,3-Benzenediacetonitrile to create complex chromophores required for stable, high-performance colorants. Its tolunitrile moiety supports the formation of extended aromatic systems through condensation and cyclization reactions. The intermediate’s high purity is essential to achieve consistent color yield and lightfastness, with strict control on contaminant species that can cause batch color deviations.

    Industry compliance standards

    • OEKO-TEX Standard 100 (for textile dye ingredients)
    • Regulation (EC) No 1907/2006 (REACH) for chemical substance registration
    • ISO 1248 (Testing of color fastness in dyes and pigments)
    • ZDHC MRSL (Manufacturing Restricted Substances List for textiles)

    Typical usage ratio

    • From 7% up to 20% w/w relative to main backbone reactant in condensation or azo coupling reactions
    • Varies with pigment structure complexity and shade requirement

    Downstream process integration

    • Added during core chromophore synthesis or late-stage ring closure
    • Processed in stirred reactors under inert atmosphere and controlled solvent system
    • Filtration and crystallization steps follow to isolate target pigment intermediate

    Final product types

    • High-performance textile dyes
    • Industrial organic pigments for plastics or coatings
    • Azo and anthraquinone derivatives for specialty color solutions

    4. Electronics Chemicals: Liquid Crystal and OLED Intermediate Synthesis

    In the electronics materials sector, 5-Methyl-1,3-Benzenediacetonitrile plays a role building advanced organic intermediates for display and photonics applications. It supports the synthesis of symmetric and asymmetric aromatic cores used in the preparation of liquid crystal compounds or as precursor units for OLED emitter structures. Purity and batch consistency directly influence display device efficiency and longevity, making specialized grade control essential.

    Industry compliance standards

    • IEC 62474 (Material declaration for electronic industry)
    • RoHS Directive 2011/65/EU (Restriction of Hazardous Substances)
    • ISO 9001:2015 for quality management in electronic chemical production
    • JIS C 6120 (Japanese standards for OLED/light-emitting materials)

    Typical usage ratio

    • 1–6% molar ratio in target molecule synthesis steps depending on required conjugation
    • Adjusted process-by-process, factoring in chain length and substituent requirements

    Downstream process integration

    • Fed into ring-closing or functionalization stages in pilot glass or PTFE-jacketed reactors
    • Purified via controlled crystallization or chromatography to semiconductor-grade standards
    • Quality checked by advanced spectroscopy (NMR, LC-MS) to ensure low trace metal contamination

    Final product types

    • Liquid crystal display base materials
    • OLED emitter precursors
    • Advanced organic semiconductors for display panels
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    Certification & Compliance
    More Introduction

    Introducing 5-Methyl-1,3-Benzenediacetonitrile: The Manufacturer’s Perspective

    As a chemical manufacturer deeply invested in both quality and reliability, we’ve spent years refining the production of 5-Methyl-1,3-Benzenediacetonitrile. We work with this molecule daily, watching it fill a role in fine chemicals, specialty synthesis, and several intermediates for high-value sectors. Our experience with it stretches from early pilot batches to the current demands of multinational formulators and innovative startups alike.

    The Chemical’s Identity and Our Approach to Its Manufacture

    5-Methyl-1,3-Benzenediacetonitrile carries its methyl group at the 5-position on the benzene ring, flanked by two nitrile-functionalized acetonitrile chains at the 1 and 3 positions. Our process control ensures that side-substitution stays consistent, which is critical for companies that rely on this isomer specifically in their downstream chemistry. We take pride in minimizing byproducts, controlling moisture content, and excluding polycyclic impurities, challenges which often dog inferior batches.

    We keep our process lean but robust: each batch starts with thoroughly qualified starting materials subjected to in-house QC. Throughout the multi-step synthesis, we pay close attention to temperature stability, reaction exotherms, and purification yield. Every lot flows through a closed filtration system before drying and packing in high-integrity containers. GC-MS and NMR trace every shipment back to individual operators and raw material batches, tracking both strengths and improvements.

    Specifications Drawn from Our Field Experience

    Our typical product offers a purity of greater than 99% by HPLC, with moisture content below 0.2%. We understand that the presence of ortho- or meta-isomers can throw off downstream yields, especially when used in advanced materials or pharma syntheses. Rigorous isomer ratio controls, guaranteed residual solvent content, and trace metal limits stem not from generic specs, but from hard lessons gathered over thousands of kilograms produced.

    Our experience showed that customers in electronic chemicals prioritize ash content and particle size fractionation, while those working in small-molecule pharma often focus on route selectivity. As manufacturers, we tailor our finishing—whether customers request high-purity crystalline lots or need a technical-grade solution—relying on direct feedback from chemists putting the product into their own reactors, not just market surveys.

    Application: Insights from Direct Use and Customer Projects

    5-Methyl-1,3-Benzenediacetonitrile plays a central part in technical and specialty synthesis. We’ve seen it serve as a starting block for novel organic electronics and as a building unit in custom ligands for catalysis. Some of our partners develop next-generation UV absorbers, where this molecule’s aromatic rigidity and electron-withdrawing nitriles build the chromophore’s backbone. In pharmaceutical applications, it stands out as an intermediate in the route toward active compounds, particularly where substitution patterns must match tightly regulated patent claims.

    Through dozens of successful scale-ups for both R&D and production customers, we’ve noticed challenges often arise around dissolution, reactivity, or filtration during work-up. Our technical support comes not just from written protocols but from conversations on the plant floor, where fine-tuning filtration methods and identifying key crystallization points matter most.

    A common question: how does 5-Methyl-1,3-Benzenediacetonitrile compare to other meta-substituted nitrile derivatives? In our work, the methyl group alters core performance. Compared to the unsubstituted 1,3-Benzenediacetonitrile, methylation at the 5-position changes solubility, the electrophilicity of adjacent nitrile carbons, and even influences how intermediates behave under catalytic hydrogenation or cross-coupling. The result means it unlocks avenues inaccessible to unsubstituted analogs, dictating yield, selectivity and even the color and texture of final products.

    Differences from Standard Products: Lessons from the Lab and Factory Floor

    In our factory, we've run side-by-side trials. Standard 1,3-Benzenediacetonitrile often leaves end-users battling heavier byproduct formation in high-load processes. The methylated variant consistently produces lighter mother liquors, which reduce downtime spent cleaning reactors and filters. This direct feedback from an operator’s logbook translates to measurable savings for production chemists.

    Further, the methyl group cuts reactivity toward common bases, making it more forgiving during condensation or alkylation steps. Several industrial partners count on this subtle stability. In pigment synthesis, for example, side-reaction rates drop, improving batch-to-batch reproducibility. This isn’t theory: our own kilo-lot shipments documented fewer non-conforming lots compared to other isomers or unmethylated variants.

    Color, too, matters outside analytical labs. Crudes from methylated derivatives generally present less color development on storage. Partners using highly visible end products, such as light-sensitive coatings or optical materials, have switched over and reported lower variability even after weeks in transit or storage.

    Addressing Challenges in Handling and Delivery

    Not all differences show up in tables of numbers. 5-Methyl-1,3-Benzenediacetonitrile has a practical advantage: it packs more efficiently due to its denser crystalline structure, which resists caking and allows for easier sampling by warehouse teams. We fielded early complaints about “rocky” or “clumpy” material from end-users when shipping alternatives. Over the years, process optimization—especially in the drying step—helped us deliver a consistently free-flowing material that operators can weigh and subdivide without mechanical milling or sieving.

    Packing touches every container that leaves our plant. Each drum or sack seals independently and uses robust liners to prevent contamination. Live monitoring during filling and automated weight checks ensure the product remains secure to the last kilogram. Details like these matter for international customers facing long transport times, where temperature swings or delays challenge the limits of packaging. Feedback from partners in tropical regions confirmed that our product’s physical form resists humidity-driven caking and re-compaction better than alternatives.

    Practical Insights for Safe and Effective Usage

    Long years in manufacturing have taught us that theoretical purity or even a detailed CoA don’t guarantee performance at scale. Staff need to handle the material safely, with complete information about hazards and proper procedures for spills or exposure. We provide explicit guidance, drawing from decades of on-site audits and root-cause investigation of even minor incidents. For us, safety starts in the utility room and ends at dockside—everywhere the chemical moves within our plant.

    We constantly analyze feedback from technicians about product flow, dust formation, and personnel exposure, then update our standard operating procedures to address real-world risks. As for storage, we’ve redesigned warehouse layouts and containers to keep the material dry, sealed, and accessible. These improvements stem from lived experience, not a distant corporate handbook, and have helped partners improve their own plant safety.

    Quality Assurance: Trust Built Through Experience

    No manufacturing line can afford product rejections or return shipments. Over years spent meeting ever tighter product standards and performance benchmarks, we’ve implemented both in-process controls and end-point analytics, with each shift cross-checked by team leads. Consistent sample retention and scheduled audits help us understand not just batch-to-batch variation, but also changes linked to seasonality, humidity, or operator behavior.

    Third-party certification is far from a paper exercise for us. We treat it as an ongoing dialogue: each audit turns up nuanced points about solvent purity, raw material traceability, or waste minimization. Our QC staff received hands-on training from former production chemists, so they understand how an outlier reading from the GC may translate into a recall or missed step in a downstream plant.

    In developing advanced materials or regulated pharmaceuticals, customers want more than a product—they want confidence that each shipment truly meets specification. Our data logs extend years back, documenting every action from the receiving dock to the final ship date. When issues arise, the conversation isn’t about placing blame, but about analyzing process drift, validating corrective action, and reporting transparently. This has earned us the trust of repeat partners, some of whom share their own process data, helping us find unexpected ways to refine our protocols and ultimately raise the bar for any manufacturer in this field.

    Environmental Responsibility: What We've Learned on the Ground

    From the earliest days, questions about waste management and emissions remain front and center in fine chemical production. We routinely collaborate with stakeholders on emission abatement, on-site solvent recovery, and responsible waste disposal. For 5-Methyl-1,3-Benzenediacetonitrile, improving yield has always meant less solvent burned off and less organic residue to landfill. Our teams run pilot programs to capture and recycle solvents whenever feasible, and regular environmental audits help us catch leaks, operational inefficiencies, or overlooked improvement opportunities early.

    We know that many partners prioritize green chemistry and expect their suppliers to minimize resource footprints. Several years ago, internal research reduced water usage in rinsing by altering the crystallization regimen. The change meant fewer wash cycles and less treated wastewater, saving both money and natural resources. These lessons make their way into our daily routines—and into the guidance we share with process chemists who want to compound the environmental advantages throughout their own supply chains.

    Comparing Market Offerings: Why Manufacturing Source Matters

    Many customers ask us why direct purchase from the manufacturer beats going through layers of resellers. In our experience, it’s the transparency, responsiveness, and accountability that make a difference. We stand behind every shipment—if a batch turns cloudy or develops off-color, customers know precisely who to call and what data supports each prior decision. Counterfeit or diluted materials have disrupted production lines at some customers who sourced through unvetted traders. Through careful vetting and regular site visits, our partners know their supply chain can withstand audits and recalls.

    We’ve met buyers who burned through months chasing “cheaper” substitutes, only to discover payback comes in lost yields, repeated filter blockages, or costly process troubleshooting. At our plant, we invite customers to observe critical steps or run their own verification tests on-site. That kind of trust can only grow through direct, repeat interaction—not an abstract number on a price sheet.

    Continuous Improvement: Beyond the Technical Specification

    The chemistry marketplace never stands still—so neither do we. Every major upgrade to our product or process relied on lessons learned from daily production, failures, near-misses, and input from wide-ranging customers. Sometimes the changes appear minor, such as a tweak to mixing speed or a new drying profile, but the cumulative result delivers more reliable material and smoother operations for every user down the line.

    Cross-functional teams blend experience from plant operators, QC analysts, and application chemists. This diversity means problems are addressed with insight across the full value chain, not just from a lab or marketing office. For example, a simple upgrade to the filtration sequence surfaced after comparing notes with a customer who noticed intermittent particle formation in their reactor. Implementing this update improved our yield and ended a recurring customer complaint.

    Investing in people, equipment, and honest communication keeps the bar rising. We routinely welcome suggestions, questions, and criticism from customers who rely on our product for their own success. The trust built through genuine partnership, data sharing, and technical transparency cannot be replaced by abstract marketing messages or standardized forms.

    Looking Forward: Facing Industry Demands with Confidence

    As demand for advanced chemicals intensifies, we remain focused on what truly matters: quality, reliability, and open collaboration. The 5-Methyl-1,3-Benzenediacetonitrile we produce stands on a foundation of technical expertise, factory-floor experience, and direct conversations with those who use it in the real world.

    Each drum or package reflects more than raw material—it carries the weight of lessons learned, processes improved, and partnerships built through hard work and accountability. We continue investing in technology and people to ensure every batch meets the expectations of those who rely on consistency, traceability, and responsive support.

    For us, 5-Methyl-1,3-Benzenediacetonitrile isn’t just another product code. It's the outcome of a decades-long commitment to chemical manufacturing done right: learning from success and setbacks, adapting to new challenges, and taking real pride in contributing to customers’ progress and accomplishments.