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2-Cyanomethylbenzoic Acid Methyl Ester

    • Product Name 2-Cyanomethylbenzoic Acid Methyl Ester
    • Alias Methyl 2-(cyanomethyl)benzoate
    • Einecs 406-110-0
    • 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
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    Specifications

    HS Code

    743315

    Product Name 2-Cyanomethylbenzoic Acid Methyl Ester
    Synonyms Methyl 2-(cyanomethyl)benzoate
    Molecular Formula C10H9NO2
    Molecular Weight 175.18 g/mol
    Cas Number 591779-33-2
    Appearance White to off-white solid
    Melting Point 56-60°C
    Solubility Soluble in organic solvents (e.g., dichloromethane, ethanol)
    Purity Typically ≥98%
    Smiles COC(=O)c1ccccc1CC#N
    Inchi InChI=1S/C10H9NO2/c1-13-10(12)8-5-3-2-4-7(8)6-9-11/h2-5H,6H2,1H3
    Storage Conditions Store at 2-8°C, protect from light and moisture

    As an accredited 2-Cyanomethylbenzoic Acid Methyl Ester factory, we enforce strict quality protocols—every batch undergoes rigorous testing to ensure consistent efficacy and safety standards.

    Packing & Storage
    Packing A clear, securely sealed glass bottle containing 25 grams of 2-Cyanomethylbenzoic Acid Methyl Ester, labeled with chemical details and hazard warnings.
    Shipping 2-Cyanomethylbenzoic Acid Methyl Ester is shipped in tightly sealed, chemical-resistant containers to prevent leaks and contamination. The container is clearly labeled with hazard warnings. It is transported under ambient conditions, avoiding excessive heat, moisture, and direct sunlight. Standard chemical shipping regulations and documentation are strictly followed to ensure safe delivery.
    Storage 2-Cyanomethylbenzoic acid methyl ester should be stored in a tightly sealed container, away from moisture, heat, and direct sunlight. Keep it in a cool, dry, and well-ventilated area, preferably in a designated chemical storage cabinet. Ensure compatibility by storing it away from strong oxidizing agents and acids. Always follow standard laboratory safety protocols and local regulations for chemical storage.
    Application of 2-Cyanomethylbenzoic Acid Methyl Ester

    Applications of 2-Cyanomethylbenzoic Acid Methyl Ester in Industrial Manufacturing

    As a proven manufacturer of 2-Cyanomethylbenzoic Acid Methyl Ester, we focus on enabling advanced synthesis routes and quality control for leading international producers. The following scenarios illustrate how this intermediate brings precise reproducibility and compliance to select high-value markets where chemical performance and process reliability are critical.

    1. Pharmaceutical Intermediate Synthesis

    Major pharmaceutical companies utilize 2-Cyanomethylbenzoic Acid Methyl Ester as a coupling intermediate for the preparation of specific active ingredient scaffolds, especially in the development of antihypertensive and anticancer agents. Use requires absolute process traceability and consistency from initial reaction steps, as downstream hydrolysis and amidation steps demand high-purity intermediates to meet API-grade standards. Careful ratio adjustment ensures process yield and impurity control across multiple proprietary synthesis platforms.

    Industry compliance standards

    • ICH Q7 Good Manufacturing Practice for Active Pharmaceutical Ingredients
    • USP and EP monographs for final APIs containing related structures
    • FDA 21 CFR Part 210/211 (current Good Manufacturing Practice)
    • EU GMP guidelines (EudraLex Volume 4)

    Typical usage ratio

    • 0.2–0.5 molar equivalents relative to key amine or nucleophile substrates, adjusted according to target molecule synthesis pathway and desired yield.

    Downstream process integration

    • Introduced during the primary condensation or alkylation stage via charged addition, prior to main ring closure or amidation. Continuous in-line monitoring is often employed at this step.

    Final product types

    • Active pharmaceutical ingredients (e.g., benzoic acid derivatives, targeted small molecules)
    • Regulatory-submitted drug substances requiring full traceability

    2. Agrochemical Intermediate Manufacturing

    Producers of advanced herbicides and selective fungicides source this compound for introducing specific aromatic side chains through nucleophilic substitution and hydrolysis during multi-step agrochemical synthesis. It supports manufacturing routes with strict batch reproducibility and environmental documentation, as sector leaders must comply with strict global crop protection regulations.

    Industry compliance standards

    • FAO/WHO specifications for technical active ingredients
    • OECD guidelines for chemical safety and impurity control
    • REACH (Registration, Evaluation, Authorisation and Restriction of Chemicals, EU)
    • SANTE/11813/2017 (EU pesticide residue analysis)

    Typical usage ratio

    • 5–12% by mass in precursor stages, with adjustment depending on the final product’s aromatic substitution requirements and functionalization steps.

    Downstream process integration

    • Fed to the reaction vessel following initial halogenation or cyanation, typically in the second or third synthesis step, supporting precise aromatic backbone formation and intermediate purification.

    Final product types

    • Commercial herbicide active ingredients (e.g., substituted benzoic acid esters)
    • Fungicide building blocks for further transformation

    3. Specialty Dye and Pigment Synthesis

    Manufacturers of high-performance pigments and custom aromatic dyes use 2-Cyanomethylbenzoic Acid Methyl Ester to introduce electron-withdrawing cyanomethyl groups, supporting color fastness and stability for demanding textile and polymer applications. Regulatory review of input chemicals ensures downstream batch export compliance and quality certification.

    Industry compliance standards

    • OEKO-TEX® Standard 100 (input chemistry list, textiles)
    • REACH Annex XVII (restrictions on polyaromatic compounds)
    • ECO PASSPORT by OEKO-TEX® (chemical inputs for dye manufacturing)
    • ISO 9001:2015 for quality management systems

    Typical usage ratio

    • 3–10% weight basis in dye intermediate reactions, varying with chromophore extension needs and degree of aromatic substitution required for the target color shade.

    Downstream process integration

    • Charged after the initial diazotization or alkylation phase, allowing precise control over color intensity and molecular configuration of the pigment structure.

    Final product types

    • Sulfonated and azo dyes for synthetic fiber dyeing
    • Polyester and polyamide-compatible specialty pigments

    4. Fine Chemical Building Block for Electronic Materials

    Technical producers in the electronic materials sector, particularly those manufacturing organic semiconductors and advanced liquid crystal intermediates, select this compound for its consistent aromatic backbone, supporting tight control of dielectric and optical properties. The purity and batch consistency directly affect downstream electronic performance and device qualification.

    Industry compliance standards

    • IPC-4101D (specification for base materials in printed boards)
    • ISO 14001 (environmental management in chemical manufacturing)
    • JEDEC JESD22 (electronics reliability test standards)
    • RoHS Directive 2011/65/EU (restricted substances in electronics)

    Typical usage ratio

    • 0.5–2% within precursor solution formulations, ratio optimized for polymerizable function integration and target electrical property adjustment.

    Downstream process integration

    • Added during early chemical synthesis of monomer precursors immediately prior to oligomerization or crosslinking, ensuring uniform integration at the molecular design stage.

    Final product types

    • Organic semiconductor base materials
    • Liquid crystal additives for advanced display panels
    • Polymerizable intermediates for specialty film deposition

    5. Research and Analytical Reference Material Preparation

    Producers of analytical standards and research intermediates incorporate 2-Cyanomethylbenzoic Acid Methyl Ester for use as an authentic reference standard or calibration material due to its consistent reactivity and quantifiable purity. These applications demand rigorous documentation and chain of custody as required by global analytical validation protocols.

    Industry compliance standards

    • ISO/IEC 17025 (general requirements for laboratory competence)
    • USP–NF reference standard protocols
    • ICH Q3A/B (impurity testing of drug substances and products)
    • GLP (Good Laboratory Practice, OECD/GFSI recognized)

    Typical usage ratio

    • Employed as a pure standard material (99.5% purity minimum), weighed into precise, analytical-scale quantities as required by method or instrument validation procedures.

    Downstream process integration

    • Packaged and distributed directly as a reference compound, or used to spike samples in analytical method development, typically at the compound isolation or post-purification stage.

    Final product types

    • Certified reference materials for analytical chemistry labs
    • Analytical standards for HPLC/GC/MS method calibration
    • Internal standards for impurity profiling in manufacturing QC
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    Certification & Compliance
    More Introduction

    2-Cyanomethylbenzoic Acid Methyl Ester: Precision Chemistry Rooted in Real Manufacturing

    Building Value with 2-Cyanomethylbenzoic Acid Methyl Ester

    Every day in our plant, we handle chemistry that shapes the foundations of new pharmaceutical synthesis and advanced material science. Among many building-block compounds, 2-Cyanomethylbenzoic Acid Methyl Ester stands apart for its clean reactivity and defined structure. This product, known by its systematic name methyl 2-(cyanomethyl)benzoate, flows straight from our reactors and purification units with predictable, consistent quality. Over years refining this compound’s preparation, we have learned to recognize the importance of trace impurity management and robust analytical fingerprinting.

    The molecular formula C10H9NO2 means every batch features the methyl ester linked to a benzoic acid core via a cyanomethyl group. It’s a subtle difference from more familiar materials such as simple benzoic acid esters or phenylacetonitrile. The added carboxylic ester gives a reactivity pattern different from just a nitrile on its own. Down the supply chain, that often translates to shorter downstream transformations or higher yields in pharmaceutical intermediate production. From our benches, this translates into fewer side products, less re-work, and more reliability for our downstream users.

    A Closer Look: Model and Specifications

    In our experience, model and grade matter whenever a synthetic route must hit its mark. We offer 2-Cyanomethylbenzoic Acid Methyl Ester in a crystalline form, normally with purity well above 98%. We keep water content in check by vacuum drying and check residual solvents on every drum and bottle. Melting point runs a tight range, so customers interested in solid phase synthesis receive material engineered for their reactions, without dust or sticky agglomerates.

    We approach each batch with batch-numbered analytical records, full HPLC chromatograms, and NMR spectra to verify structure and purity. Our team maintains GLP compliance and can support additional documentation where regulatory files require it. While most users order by standard bottle sizes, we can scale output for pilot or production campaigns. Our reactors and filtration set-ups handle scale transfers without skipping quality checks.

    Comparing this to methyl benzoate or ortho-substituted nitriles we also manufacture, the extra step in the synthesis — cyanomethylation of the benzoate core — takes careful handling of reagents and continuous process monitoring. We run in glass-lined reactors with nitrogen blanketing to protect functional groups and minimize oxidation. The extra operational control means fewer byproducts and higher reproducibility, so process chemists downstream notice fewer surprises.

    Practical Usage Across Sectors

    A major segment of our 2-Cyanomethylbenzoic Acid Methyl Ester production goes into research programs for new pharmaceutical agents. Medicinal chemists come to us wanting a clean, versatile scaffold for further functionalization — perhaps to build heterocycles, add amides or convert the ester to different acid derivatives. The cyanomethyl group, just a carbon away from the aromatic ring, acts as a handle for direct substitution, reductive work, or even palladium-catalyzed cross-coupling. In the hands of experienced synthetic teams, this opens the door to creative analogs that would be out of reach with simpler acids or nitriles.

    Polymer developers also find value in its unique molecular backbone. Compared to regular methyl benzoate, the nitrile function increases polarity and offers more options for post-polymerization modification. Some customers use it as a monomer or comonomer in specialty resins. Others use its intermediate status in the chain — not too reactive to cause runaway side chemistry, not so inert as to resist activation when needed.

    For our plant, the end use often influences the way we fine-tune drying, packaging, and stability assurances. We supply partners with gram-level analytical batches for initial screening, and then coordinate bulk shipments for process validation. Feedback from these partners has shaped how we filter, sieve, and monitor particle size, so the compound performs as expected in their glassware or reactors.

    Quality, Reliability, and Process Know-How

    Years of operating chemical production lines have shown that reliability comes from consistency — not just purity, but in the complete chemical profile. Our in-house team developed control charts for parameters like solvent residues, trace metal levels, and even particle morphology. By tightening our control, we reduce variability, which pays dividends on the receiving end of the supply chain: reaction times drop, yields rise, cleaning cycles shorten.

    We have also learned that logistics can make or break the use of specialty chemicals like this. The methyl ester needs moisture-controlled packaging to prevent slow hydrolysis, so we store and ship in airtight, lined drums or bottles. Customers on three continents place regular orders, so we track every stage of storage and transport for stability, temperature, and tamper-proofing. We welcome audit requests, and our regular customers send their own teams to our site to see our process and batch records.

    Unlike multisource commodity chemicals, specialty esters like this benefit from close collaboration between manufacturer and end-user. We have walked many labs through analytical updates, regulatory filings, or change-control reports. This process requires both transparency and technical dialogue, never generic technical bulletins or canned presentations.

    What Sets 2-Cyanomethylbenzoic Acid Methyl Ester Apart?

    Our path to scaling the 2-Cyanomethylbenzoic Acid Methyl Ester process built on decades of aromatic ester chemistry. Other esters — methyl 4-cyanobenzoate, methyl 2-methylbenzoate — follow simpler workflows. 2-Cyanomethylbenzoic Acid Methyl Ester, with its ortho-geminal cyanomethyl, presents more subtle synthesis and purification demands. Not every producer is equipped to execute the reaction with high selectivity or to separate the by-products typical of side-chain functionalization.

    End-users often compare it not only to other esters of benzoic acid but also to other functionalized aromatics. Our product carries fewer contaminating isomers or residual reactants. This can translate to cleaner progress in multi-step pharmaceutical synthesis, a real advantage when regulatory filings depend on trace impurity control. We keep in close contact with research partners, so when a structural variant or higher selectivity is needed, our team modifies the procedure without cutting corners on safety or documentation.

    Another area where this material stands out is in compatibility with downstream transformations. Some esters resist hydrolysis or aminolysis, but the structure of 2-Cyanomethylbenzoic Acid Methyl Ester lends itself well to both. In practical terms, that means users can choose pathways — reduction, condensation, cyclization — with fewer reaction work-ups and simpler purification schemes.

    Challenges and Continuous Improvement in Manufacturing

    To a manufacturer, every product line carries its own technical challenges. With 2-Cyanomethylbenzoic Acid Methyl Ester, the main hurdles have centered on cyanomethylation’s selectivity and purity controls. The intermediate stages create minor by-products if temperature or stirring drifts outside the set range, so we use digital monitoring and closed control loops on our equipment. Our chemists track the process at each step, collecting samples for both in-process and endpoint analytical checks, using GC-MS and NMR.

    Waste minimization holds a prominent place in our workflow. We optimize solvent recycling and rigorously segregate waste streams to minimize environmental impact. This approach stems from our broader shift to responsible chemical manufacturing, in line with updated environmental legislation and internal safety targets.

    Staff training and cross-checks help reduce error rates and near-misses. Each operator undergoes stepwise training on this line, building up from supporting roles to lead operation. Our process engineers hold weekly reviews of equipment logbooks and monitor product yield trends, flagging anything outside the target range for intervention before batches move forward.

    End-User Perspective: How Producers Help Solve Downstream Issues

    We build chemistry lines based on what we hear from our customers’ labs. Many find that standard, off-the-shelf intermediates fall short in advanced syntheses; reaction profiles shift, impurities accumulate, or downstream products underperform. Our team approaches these problems through active dialogue, encouraging researchers to share their pain points with us and, whenever possible, sending samples or process data to help.

    This feedback has led us to alter drying temperatures, vary solvent choices, and design custom batch splits. We have developed procedures that offer extended shelf-stability for sensitive projects, as well as fast-track delivery modes to laboratories working on pressing projects. For partners working on anti-infectives, one minor contaminant can hold back months of research. By monitoring and controlling trace levels down to parts-per-million, our operators help protect those programs from setbacks that would otherwise occur with less rigorously made material.

    Practical Differences from Other Products in the Benzoic Acid Family

    From an industrial chemist’s point of view, not all benzoic acid derivatives behave the same way in processing or in reactions. Take methyl 2-methylbenzoate, for example: it comes together readily, but lacks the capacity to participate in cross-coupling or nucleophilic addition at the side-chain. Methyl 4-cyanobenzoate, by contrast, puts the cyano group at a different position — which changes both electronic effects and reactivity.

    2-Cyanomethylbenzoic Acid Methyl Ester provides a combination of reactivity and selectivity that advanced synthetic methods need. Its particular structure means it can act as a masked intermediate for both nucleophilic and electrophilic pathways. Chemists interested in forming complex, fused heterocycles find the ortho positioning advantageous; ring closure reactions proceed more efficiently, and alternative substitution patterns become accessible.

    Compared to more basic esters, our product brings higher diversity for analog synthesis. This level of versatility can’t be matched by a simple methyl ester or straight-chain nitrile, so academic groups and process development teams tend to keep our product stocked for method development.

    Supporting Responsible, Safe Chemistry

    Our experience as a chemical producer influences how we think about stewardship and safety. All manufacturing stages, from raw material intake to finished product, follow site safety standards and environmental guidelines. We run emergency response drills and collect feedback on handling and safety practices, both for our own operators and for our partners. SDS paperwork is kept up to date and translated for all client sites.

    Ethical sourcing underpins our raw material buying, so traceability is maintained from the first step of synthesis. In some cases, we have changed upstream suppliers to reduce carbon footprint or improve worker safety at the source. Batch records are archived for regulatory reference, and we perform internal audits on material flows, waste management, and risk assessments.

    Openness and Partnership: The Human Side of Production

    In running our manufacturing teams, we see productivity and problem-solving thrive most when customers and chemists work side by side. Many end-users have visited our facility, reviewing how their critical raw materials are actually made. We encourage this interaction; chemists gain confidence in the supply chain and we gain real insight into what matters in practice. By eliminating unnecessary mystery around process steps or quality analytics, we build relationships and better products.

    Every lot of 2-Cyanomethylbenzoic Acid Methyl Ester encapsulates this genuine cooperation — from introductory calls to sample approvals and bulk logistics. Sometimes a project calls for tighter particle size, sometimes it needs lot-to-lot reproducibility tracked across a year or more. We’re not just filling drums, but actively supporting projects that depend on consistent building blocks for breakthroughs in chemistry.

    We welcome technical questions, and enjoy hearing about challenges at the bench or in scale-up, because that’s where we make our real impact: delivering a specialty ester that not only performs reliably, but empowers new directions in synthesis. Our work isn’t just about molecules; it’s about helping others reach new scientific ground.

    Conclusion: Focus on Real-World, Real-Solutions Chemistry

    2-Cyanomethylbenzoic Acid Methyl Ester reflects the merger of advanced synthetic know-how and a practical, end-user focus. By investing in precise quality management, safe production, and two-way technical exchange, we help chemists unlock new routes and outcomes across pharmaceuticals and advanced materials. Reliable supply, traceable production, and deep technical trust matter at every stage. We stand behind not just the molecule, but all the knowledge and attention that shape each batch, so end-users can push science forward with confidence.