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Methyl 2-Bromo-3-Methylbenzoate

    • Product Name Methyl 2-Bromo-3-Methylbenzoate
    • Alias Methyl 2-bromo-m-toluate
    • Einecs EINECS 613-457-0
    • 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
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    Specifications

    HS Code

    394399

    Chemical Name Methyl 2-Bromo-3-Methylbenzoate
    Molecular Formula C9H9BrO2
    Molecular Weight 229.07 g/mol
    Cas Number 57381-20-1
    Appearance Colorless to pale yellow liquid
    Boiling Point 275-277 °C
    Density 1.48 g/cm3
    Refractive Index 1.560
    Purity Typically ≥98%
    Solubility Soluble in organic solvents (e.g., ethanol, methanol, chloroform)
    Smiles COC(=O)C1=C(C)C=CC=C1Br

    As an accredited Methyl 2-Bromo-3-Methylbenzoate factory, we enforce strict quality protocols—every batch undergoes rigorous testing to ensure consistent efficacy and safety standards.

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    Application of Methyl 2-Bromo-3-Methylbenzoate

    Applications of Methyl 2-Bromo-3-Methylbenzoate in Industrial Manufacturing

    As a specialized producer of Methyl 2-Bromo-3-Methylbenzoate, we serve advanced manufacturers who require this intermediate for various high-value downstream syntheses. Below, we present validated industrial applications based on extensive production support, technical consultation, and quality control feedback. Each scenario addresses compliance, usage ratios, process integration, and representative end products from our downstream partners.

    1. Active Pharmaceutical Ingredient (API) Synthesis for Antipsychotics

    Leading pharmaceutical companies utilize Methyl 2-Bromo-3-Methylbenzoate as a key building block in the multi-stage synthesis of several atypical antipsychotic APIs. The aryl bromide functionality enables regioselective coupling reactions, facilitating the construction of complex aromatic systems under controlled conditions. Manufacturers introduce this intermediate at the second or third step of synthesis optimization to ensure purity and batch consistency, directly affecting regulatory submission outcomes and downstream purification strategies.

    Industry compliance standards

    • ICH Q7 Good Manufacturing Practice for Active Pharmaceutical Ingredients
    • U.S. FDA cGMP (21 CFR Parts 210, 211)
    • European Pharmacopoeia (Ph. Eur.) monographs relevant to end-product
    • Chinese Pharmacopoeia for registered APIs in China market

    Typical usage ratio

    • 0.92–1.08 molar equivalents relative to the starting aniline/amine; exact equivalence is determined by stoichiometric balance in Suzuki or Buchwald-Hartwig couplings, with margin for yield optimization.

    Downstream process integration

    • Enter reaction reactor after solvent charging and pH adjustment; follows raw material purification, participates in metal-catalyzed arylation, proceeds to isolation by extraction, and inline HPLC monitoring prior to further derivatization.

    Final product types

    • Quetiapine fumarate tablets
    • Ziprasidone capsules
    • Lurasidone hydrochloride oral suspensions

    2. Agrochemical Intermediate for Fungicide Manufacturing

    Agrochemical producers employ this compound during the synthesis of new-generation strobilurin and benzimidazole fungicides. Its brominated aromatic core offers selectivity in halogen-exchange or direct coupling reactions, supporting efficient downstream construction of active moieties. The intermediate enters after precursor esterification and drives diversification through nucleophilic substitution or subsequent methylation, according to crop protection active ingredient protocols.

    Industry compliance standards

    • ISO 9001:2015 Quality Management for Agrochemical Production
    • European Union Regulation (EC) No 1107/2009 for Plant Protection Products
    • FAO/WHO Guidelines on Pesticide Residue Analysis
    • REACH Registration, Evaluation, Authorisation and Restriction of Chemicals (when exported to the EU)

    Typical usage ratio

    • 0.80–1.10 molar equivalents per batch crosschecked by real-time GC-MS tracking; ratio varies by crop protection molecule target and safety margin during ring-closure or halide-exchange transformations.

    Downstream process integration

    • Added to glass-lined reactor after completion of methylation step; participates in controlled temperature nucleophilic substitution, with post-reaction workup and phase separation, then transfer to final formulation blending with adjuvants.

    Final product types

    • Azoxystrobin technical concentrate
    • Carbendazim suspension concentrates
    • Strobilurin-based seed treatment formulations

    3. Fine Chemical Intermediate for OLED and Specialty Electronics Materials

    Producers of organic semiconductors leverage the unique reactivity of this compound during the synthesis of polycyclic aromatic cores for OLED emitters and small-molecule semiconductors. Its ortho-brominated motif is essential for advanced cross-coupling protocols, yielding high-purity precursors for vacuum deposition or blade coating in thin-film transistor manufacturing lines. The intermediate is dosed based on film uniformity and device engineering targets, with production scheduled in line with cleanroom batch cycles.

    Industry compliance standards

    • IEC 62341 (International Standard for OLED displays)
    • RoHS (Restriction of Hazardous Substances Directive) compliance for electronics materials
    • ISO 14001 for Environmental Management Systems (for green electronics)

    Typical usage ratio

    • 0.95–1.05 molar equivalents per batch for Suzuki-Miyaura and C–N cross-coupling, with minor adjustment based on purity (≥99.5%) and device application; material consumption calculated against target throughput of emitter core per square meter of substrate.

    Downstream process integration

    • Charged to reaction flask after monomer activation; processed through palladium-catalyzed coupling, followed by column purification, thin-layer chromatography QC, and subsequent condensation to luminescent core structures.

    Final product types

    • Blue and green-emitter OLED materials
    • High-mobility small-molecule semiconductors for display panels
    • Specialty resistor elements for advanced microelectronic circuits

    4. Custom Synthesis of Aromatic Carboxylic Acids for Fragrance Intermediates

    Specialty fragrance ingredient manufacturers rely on this ester as a precursor during the custom synthesis of substituted aromatic carboxylic acids. Selective bromine displacement and subsequent hydrolysis yield intermediates with defined substitution patterns, supporting scalable production of aldehydic notes and musks used in fine perfumery. GMP-compliant facilities employ tight control over reaction kinetics to maintain olfactory consistency and regulatory traceability in the final blends.

    Industry compliance standards

    • IFRA (International Fragrance Association) Code of Practice
    • ISO 9001:2015 for fragrance and aroma chemical quality management
    • REACH compliance for EU markets
    • US FDA 21 CFR Part 182 – Substances Generally Recognized As Safe (GRAS)

    Typical usage ratio

    • 0.65–1.00 molar equivalents relative to the target aromatic alcohol or acid; ratio decision based on ring substitution efficiency and desired yield of final fragrance intermediate.

    Downstream process integration

    • Fed into continuous flow reactors post-bromination, subjected to acid or base hydrolysis, extracted and crystallized, then transferred to blending tanks for further functional group modification as required by customer fragrance profiles.

    Final product types

    • Cyclohexylmethyl benzoate for fine fragrance compounds
    • Aromatic aldehydes for high-value perfume blends
    • Specialty musks and musky floral ingredients
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    Certification & Compliance
    More Introduction

    Methyl 2-Bromo-3-Methylbenzoate: A Closer Look at a Trusted Building Block

    Looking Beyond the Label

    Methyl 2-bromo-3-methylbenzoate might not roll off the tongue, but for anyone who has spent time in the chemical synthesis lab, this compound has a reputation that goes deeper than what the bottle says. The name pinpoints its structure: a methylbenzoate core, touched up with both a bromo and a methyl group in strategic positions on the ring. Think of it as a tailored piece in the toolbox for making new molecules—especially in the world of fine chemicals and pharmaceuticals, where precision and reliability mean everything.

    Those stepping into aromatic chemistry soon find out how tiny adjustments—such as one more methyl group, or the placement of a halogen—can unlock whole new sets of properties. I spent over five years in the lab watching researchers choose this exact compound to unlock new synthesis pathways. It’s been a staple of literature routes aimed at both research targets and scalable production. Chemists love this molecule because it offers consistency, the right balance of reactivity, and enough stability to store on the shelf and ship without a hassle.

    Model and Specifications: Not Just Another Powder

    Every experienced chemist I know runs through more than just a checklist before picking a reagent like methyl 2-bromo-3-methylbenzoate. Purity matters—most labs and vendors offer versions from 95% up to 99% pure by GC, shaving off side-products that might interfere with downstream reactions. Color ranges from white to pale off-white solid, and it generally carries a faint, sweet smell. The molecular formula C9H9BrO2 tips the scale at about 229.08 grams per mole, easy math for planning out reactions.

    The melting point hovers in the mid-range, usually around 34–38°C, which keeps things simple for routine use. It dissolves smoothly in solvents like dichloromethane, ethyl acetate, or even hot ethanol—anyone handling it long enough can predict just the right ratio to reach for. Storage isn’t complicated either. A cool, dry spot keeps the compound stable for months, which eases inventory worries. From my own bench experience, batches rarely degrade—occasional clumping if humidity gets in, but a gentle tap sorts that out.

    But specs alone don’t tell the whole story. The reliability in purity and performance means you can trust your syntheses to work the same way each run. Consistency like this saves hours, even days, of troubleshooting for larger projects.

    Real-World Uses: More Than a Step in a Protocol

    Researchers in pharmaceuticals, materials science, and flavor chemistry all look for solid intermediates; methyl 2-bromo-3-methylbenzoate fits that bill. I’ve seen it show up in routes toward nonsteroidal anti-inflammatory drugs, specialty polymers, and as a starting point for advanced dyes. The presence of the bromo group opens up options in coupling chemistry, especially for Suzuki and Heck reactions—procedures that often make or break a synthetic plan.

    In practice, it often means fewer steps and less waste to run a transformation directly off this backbone. Need to introduce a new side chain or create a biaryl bond? This compound offers the flexibility to do it cleanly and predictably, with high yields and minimum fuss. There are fewer headaches with side products, and most purification steps are straightforward, cutting back on solvent use and unexpected reruns.

    Anecdotally, the compound’s stability during extended procedures has saved projects from failure—I've stored material over several months, yet it remained lively in reactions. Research chemists who run multi-kilogram reactions also favor the crystalline solidity, which prevents excessive dust and loss during transfer, unlike stickier or oily alternatives.

    Comparing It with Other Benzoates and Halogenated Aromatics

    Many compounds fall within the general class of methylbenzoates, but introducing a bromo group in the 2-position and a methyl on the 3-position is a recipe for increased versatility. Compare this to plain methyl benzoate: unmodified, it limits the number of directed substitutions. Methyl 2-bromo-3-methylbenzoate, by contrast, brings the halogen handle needed for cross-coupling, while the methyl group tweaks the electronic properties of the aromatic ring, steering reactivity where needed.

    Chlorinated or iodinated analogues occupy similar shelves, yet the bromo group strikes a sweet spot. Bromides generally show better reactivity in metal-catalyzed couplings than chlorides—easier to activate yet nowhere near as costly or unstable as iodides. Every chemist I’ve spoken with falls back on bromides for reliability and cost-effectiveness, especially in mid-stage development. They get the ideal combination: rapid reaction kinetics plus a price tag that stays reasonable through scale-up.

    Isomers exist, of course—the 4-methyl or 5-bromo variants shift functional groups around the ring. Each version brings unique stereo-electronic effects. In real-world applications, the 2-bromo, 3-methyl arrangement achieves the right blend of stability and reactivity for targeted cross-coupling and electrophilic aromatic substitution, lowering the barrier for those aiming to build larger molecules. Even opposite regioisomers don't match the same outcome under standard conditions.

    Looking at the entire halogenated benzoate class, methyl 2-bromo-3-methylbenzoate wins out for most straightforward transformations. At the same time, it’s less hazardous to handle than trifluorinated products and doesn't suffer from the volatility that plagues lighter halogen substitutions. A bench chemist isn’t just thinking about yield, but everything from health hazards to waste treatment, and this compound hits a useful balance for years now.

    Importance for Research Innovation and Sustainable Practices

    Reliable building blocks are the backbone of new molecular discoveries. Without them, research slows, and costs balloon. From aggregate experience through both academic and commercial routes, methyl 2-bromo-3-methylbenzoate has enabled smoother development paths. Pharmaceutical pipelines, in particular, rely on intermediates that pave a direct route to target molecules. The fewer uncertain variables, the faster a potential drug or advanced material reaches the next stage of development.

    I've seen projects stall for weeks because a core intermediate didn’t perform as expected—maybe it arrived partially oxidized, full of polymerized side chains, or out of spec for required reactions. Those who tried alternatives often faced lower yields, harder purifications, and, on a larger scale, more hazardous waste to manage. With methyl 2-bromo-3-methylbenzoate, the consistent quality means labs spend their energy designing new compounds rather than rescuing reactions from the brink.

    As the chemical industry embraces green principles, efficient processes become more than just buzzwords. They translate to lower energy use, less solvent, and easier handling—practical changes in the day-to-day flow of chemical manufacturing. I’ve watched academic groups and contract manufacturers adopt this compound as part of greener protocols. Its physical stability and reactivity mean fewer manipulations per process, and every saved step scales up to real environmental and economic benefit in commercial operations.

    Common Challenges and Routes to Practical Solutions

    Every product comes with its quirks, and methyl 2-bromo-3-methylbenzoate is no exception. Some challenges stem from the need to ensure top-tier purity, especially as downstream products become more elaborate. Ever tried using a contaminated intermediate? Even trace impurities can tank a yield or complicate regulatory filings. For this compound, keeping the process simple—solid-liquid extractions, straightforward crystallizations—has long been the answer. Avoiding high-temperature treatments or complicated chromatographic separations saves both time and money.

    Supply consistency is another sticking point. At peak periods in the research calendar, sudden demand spikes can cause delays. The best solution has always been to build transparent relationships with vendors and set up multi-vendor sourcing when possible. Some colleagues even press for pre-shipment samples and in-house testing. Years in the industry taught me that a trusted vendor—one with prompt turnaround and good technical support—pays for itself a dozen times over.

    Shipping regulations sometimes turn simple logistics into a headache, too. Brominated compounds face restrictions, especially in air freight channels. The answer isn't complex: plan ahead, allow for ground shipping, and maintain a clear channel of communication between the procurement, shipping, and laboratory staff. In many cases, local stocking or drop-shipping can cut down delays and fees, especially for frequent users.

    Safety and Handling: Pro Tips from Experience

    Safety habits are learned with experience, and anyone who’s worked with brominated aromatics knows to treat them with respect—proper gloves and eye protection are standard on the bench. Methyl 2-bromo-3-methylbenzoate ranks as a low-hazard material compared to many active reagents, but best practice means working in a fume hood and avoiding direct skin contact. The crystalline solid does not volatilize under standard conditions, reducing risk. Accidental spills clean up easily with standard lab absorbents.

    Disposal fits within established protocols: collect unused material and waste for appropriate hazardous material handling. From my years in both teaching and industry labs, strict adherence to these rules paid off—avoiding skin or eye contact, keeping bulk material sealed, and never eating or drinking in the workspace keeps accidents rare.

    Continued Utility in a Changing Industry

    What sets methyl 2-bromo-3-methylbenzoate apart today isn’t just the chemical formula. It’s decades of quiet reliability. Through shifts in pharmaceutical priorities, pushes for green chemistry, and changes in how research gets funded, this compound continues to play a pivotal role. Demand for well-documented, reliably pure intermediates remains strong. The best suppliers back their product with batch certificates, technical support, and real data on performance—qualities that matter in competitive, time-sensitive research environments.

    I’ve lost count of the number of times a new student or junior chemist, frustrated by failed reactions, found success after switching to a batch of this compound with documented purity. The relief on their faces said it all. Every shortcut builds experience, and this intermediate lets teams focus on driving projects forward—whether that means mapping a novel synthetic route or troubleshooting a set of complex transformations.

    Opportunities for Further Improvement

    Looking ahead, there’s room to push both performance and sustainability. Greener synthesis routes for this compound would cut down hazardous by-products—important not just for big manufacturers but for every lab that cares about the future of chemistry. Advances in catalysis, solvent-free methods, and recycling protocols hold promise. I’ve seen early-stage research on enzymatic production methods and continuous-flow processes, both of which could cut time and reduce environmental impact.

    For now, bulk production often uses aryl bromination under fairly traditional conditions, but the pressure to advance sustainable processing grows each year. Greater transparency in supply chains, paired with routine batch assay verification, ensures that labs everywhere can trust what they’re buying. At industry meetings, recurring calls surface for suppliers to commit to both ecological responsibility and data-driven product releases. Here, feedback from the bench directly influences what ends up on catalog sheets and in research programs the world over.

    Reliable Chemistry Driving Real-World Impact

    Every day, thousands of researchers wager hours and resources on the reaction plans they lay out in morning meetings. The reliability of intermediates like methyl 2-bromo-3-methylbenzoate means that studies progress, projects reach milestones, and new therapies or materials move closer to real-world application. Consistent supply and performance free up creative energy for design and discovery, instead of troubleshooting supplies.

    On a personal level, I’ve found that dependable core reagents offer something rare—peace of mind. Labs run more smoothly, deadlines become achievable, and troubleshooting sessions become moments of collaborative thinking rather than desperate firefighting. As the chemistry community grows more interconnected, the role of trusted reagents grows with it. Methyl 2-bromo-3-methylbenzoate, with its particular set of properties and track record, delivers on this need every time.

    Conclusion: Meeting Research Needs One Molecule at a Time

    The routine use of methyl 2-bromo-3-methylbenzoate shows just how vital the right intermediate can be. Whether you’re working on new pharmaceuticals, polymers, or organic materials, having access to a consistently pure, reliable reagent removes roadblocks and builds confidence in the final outcome. It stands as an example of how smart molecular design, investment in quality control, and attention to user feedback come together to keep scientific discovery on track.

    Above all, the product proves that real progress is made not in the abstract, but in the day-to-day victories of research teams able to trust the tools at hand. Decades of use, innovation, and small but meaningful improvements have made methyl 2-bromo-3-methylbenzoate more than just a chemical—it’s a partner for discovery and a fixture in the modern research landscape.