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Methyl 3-Bromo-4-Methoxybenzoate 98

    • Product Name Methyl 3-Bromo-4-Methoxybenzoate 98
    • Alias Methyl 3-bromo-4-methoxybenzoate
    • Einecs 609-245-5
    • 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

    575002

    Product Name Methyl 3-Bromo-4-Methoxybenzoate
    Purity 98%
    Cas Number 104245-95-4
    Molecular Formula C9H9BrO3
    Molecular Weight 245.07 g/mol
    Appearance White to off-white solid
    Melting Point 61-64°C
    Solubility Soluble in organic solvents such as DMSO and methanol
    Smiles COC1=CC(=C(C=C1)Br)C(=O)OC
    Inchi InChI=1S/C9H9BrO3/c1-12-7-4-6(10)5-8(2)9(7)13-3/h4-5H,1-3H3
    Storage Temperature 2-8°C
    Synonyms 3-Bromo-4-methoxybenzoic acid methyl ester

    As an accredited Methyl 3-Bromo-4-Methoxybenzoate 98 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 3-Bromo-4-Methoxybenzoate 98

    Applications of Methyl 3-Bromo-4-Methoxybenzoate 98 in Industrial Manufacturing

    Methyl 3-Bromo-4-Methoxybenzoate 98 serves as a specialized intermediate in high-value synthesis routes, supporting precise downstream transformations in the life sciences and specialty chemical industries. As an established chemical manufacturer, we concentrate supply on sectors where this material directly supports regulated formulations and robust production protocols.

    1. Synthesis of Pharmaceutical Intermediates (API Building Block)

    This compound acts as a core scaffold in the multi-step synthesis of advanced pharmaceutical intermediates, particularly for selective COX-2 inhibitors and emerging oncology APIs. Manufacturers employ it in reactions requiring controlled bromine introduction and protected methoxyphenyl structure for subsequent coupling or functionalization steps, ensuring traceable integration from raw material to regulatory filing.

    Industry compliance standards

    • ICH Q7 Good Manufacturing Practice for Active Pharmaceutical Ingredients
    • EU GMP EudraLex Volume 4, Part II
    • 21 CFR Part 211 (FDA cGMP for Finished Pharmaceuticals)
    • USP <823> guidelines for material traceability in clinical-stage intermediates

    Typical usage ratio

    • 0.5–1.5 molar equivalents relative to target API’s core backbone, adjustable based on molecular yield requirements and step economy.

    Downstream process integration

    • Added during protected aromatic introduction step; often subjected to Suzuki or Buchwald–Hartwig coupling in inert/reducing conditions. Reaction progress monitored by HPLC and NMR for impurity profile mapping. Integrated into multi-kilogram GMP synthesis batches with full lot traceability.

    Final product types

    • Registered pharmaceutical intermediates
    • Clinical candidate compounds for oncology and inflammation indications
    • Investigational new drug (IND) submission samples

    2. Agrochemical Active Ingredient Synthesis

    Downstream agrochemical producers use this compound as a brominated aromatic intermediate when constructing bioactive compounds for crop protection, notably in projects targeting resistance against fungal and bacterial blight. It enters stepwise syntheses where methoxy substitution enhances binding affinity and environmental stability in final pesticide formulations.

    Industry compliance standards

    • FAO/WHO Specifications for Agricultural Pesticides
    • ISO 9001:2015 Quality Management for Chemical Production
    • REACH (EC 1907/2006) safety and risk assessment dossier for all upstream intermediates
    • OECD guidelines for testing chemicals, especially GLP assessment of intermediates

    Typical usage ratio

    • 1.0–1.2 equivalents in core ring construction, fine-tuned according to batch scale and intended yield optimization for target actives.

    Downstream process integration

    • Introduction during the pre-final bond-forming stage, preceding halogen exchange or further methoxy group modification. Processors employ automated dosing systems with in-line GC/MS monitoring for reaction endpoint detection. Purification follows established crystallization or column chromatography protocols.

    Final product types

    • Broad-spectrum fungicides (e.g., azole derivatives substructure)
    • Bactericidal actives for foliar application
    • Selective herbicide precursor molecules

    3. Production of Specialty Dyes and Optical Brighteners

    As a functionalized benzoic ester, this material enters the synthesis routes for high-purity specialty dyes used in plastics, coatings, and security inks. Manufacturers in the colorant sector value the controlled bromine substitution for creating dyes with specific absorption profiles and dispersion stability, supporting both high-visibility and anti-counterfeit applications.

    Industry compliance standards

    • EN 71-3:2019 Safety of Toys – Migration of Certain Elements (where dyes may contact consumer goods)
    • ISO 9001:2015 (Dye and pigment QC and batch release)
    • REACH Annex XVII restrictions for substances in colorants
    • UL 94: Flammability rating applicable to dyes used in plastics for electronics

    Typical usage ratio

    • 0.2–0.8 molar equivalents per chromophore unit, adapted according to desired hue intensity and formulation matrix of the end dye.

    Downstream process integration

    • Direct introduction via aromatic substitution or ester cleavage during condensation and alkylation stages. Precursor handling under controlled environment to limit oxidation prior to final dye assembly. Downstream purification requires repeated filtration and solvent extraction to meet speck-free solid dye standards.

    Final product types

    • Fluorescent and visible-spectrum specialty dyes for plastics and fibers
    • Optical brighteners in high-quality paper coatings
    • Security inks for document and currency protection

    4. Advanced Chemical Research & Analytical Reference Standard Production

    Chemical research organizations and reference substance producers utilize this compound to manufacture calibration and analytical standards for structure–activity relationship investigations. Its well-defined substitution enables reliable benchmarking in method validation for both chromatographic and spectroscopic analysis in regulated laboratories.

    Industry compliance standards

    • ISO/IEC 17025:2017 General requirements for the competence of testing and calibration laboratories
    • Ph. Eur. General Chapter 5.12: Reference standards documentation
    • USP General Chapter <1225>: Validation of Compendial Procedures
    • GLP-compliant documentation for analytical standard manufacturing

    Typical usage ratio

    • Preparation of 0.1–5 mg/mL solutions for calibration, adjusted per instrument sensitivity and target quantitation limit; always documented in batch records for traceable use.

    Downstream process integration

    • Synthesized in small batches and purified by preparative HPLC or recrystallization, then gravimetrically dispensed into ampoules or vials under cleanroom conditions. Stability and purity assessed by NMR and mass spectrometry for certificate of analysis issuance.

    Final product types

    • Analytical reference standards for LC/MS and GC testing
    • Certified signal markers in HPLC-UV and HPLC-MS/MS assays
    • Research-use-only impurity markers for drug development quality control
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    More Introduction

    Methyl 3-Bromo-4-Methoxybenzoate 98: From Lab Bench to Industrial Use

    A Closer Look at Methyl 3-Bromo-4-Methoxybenzoate 98

    In the world of specialty chemicals, every compound tells its own story. Methyl 3-Bromo-4-Methoxybenzoate 98, often recognized by researchers for its reliability, bridges the gap between early-stage research and large-scale production. As a chlorinated aromatic ester with a high purity grade, this material often finds a steady place on the shelves of both academic and pharmaceutical labs. Its structure—a methoxy group next to a bromo substituent on a benzoate foundation—offers a versatile base for building more complex molecules.

    I’ve seen first-hand how sourcing a consistent, pure batch of this compound streamlines synthetic routes during pilot-scale development. The 98% assay isn’t just a number—it's a mark of reduced side reactions and greater reproducibility. People working in medicinal chemistry or process R&D tend to reach for the most reliable intermediates, because variations amplify costs and delays down the line. With this compound, the reproducibility minimizes "back to the drawing board" moments, saving both time and money.

    Digging Into the Structural Details

    At a glance, this molecule’s backbone is benzoic acid methyl ester, ornamented at the 3-position with a bromine atom and at the 4-position by a methoxy group. These groups aren’t just decorative. Their placement changes how the aromatic ring reacts with other reagents. The electron-donating methoxy group and the electron-withdrawing bromine serve as guidance systems for further substitutions, or for building more complex analogues. In practice, chemists leverage these effects to direct electrophilic or nucleophilic attacks just where they want them.

    The purity specification—98%—signals a focus on application readiness. Impurities can blur analytical results and introduce mystery peaks in HPLC traces, which can spell disaster in regulated environments. That high benchmark keeps surprises to a minimum during synthesis or downstream processing. Because of the positioning of its substituents, this compound stands apart from similar methyl benzoates. Swapping the methoxy and bromo groups, for example, can lead to a different suite of synthetic challenges and opportunities.

    Putting It to Work: Everyday Uses and Benefits

    Where does this compound fit into broader chemical applications? It often acts as a stepping-stone. In my experience, most teams using it focus on small molecule pharmaceutical development. They seek out aromatic intermediates that mesh well with coupling reactions, like Suzuki or Heck cross-couplings. In those sequences, the bromo group easily swaps for a wide variety of motifs—phenyl, heterocycle, or even more extended chains. That substituent flexibility is why it remains popular among those who need to create diverse libraries of candidate molecules, whether for cancer research, antibiotic development, or novel agrochemicals.

    A decade ago, in a joint academic-industry project, I helped optimize a process that started with this exact methyl ester. The goal? A new anti-inflammatory agent. The route hinged on the gentle reactivity of the bromo group, which formed a key bond through palladium-catalyzed coupling. Because the methoxy substituent protected one flank, side reactions dropped off, and overall yields climbed. From the benchtop flask to the pilot reactor, this intermediate played a starring role. In processes like this, small changes in substituent pattern or purity often spell the difference between scalable and dead-end chemistry.

    Comparing Apples to Apples: How It Differs from Other Benzoate Esters

    People unfamiliar with this material sometimes confuse it with its siblings. For instance, methyl 3-bromo-2-methoxybenzoate or methyl 3-chloro-4-methoxybenzoate look similar at first glance, but their behavior under lab conditions diverges precisely because of their unique arrangements and properties. In Suzuki couplings, as an example, the bromo handle outperforms its chloro counterpart, slicing hours off reaction times and sidestepping harsh conditions.

    Meanwhile, the methoxy group does more than decorate the ring. It nudges reactivity upward or downward, depending on what's asked in a sequence. If the methoxy group were swapped to the ortho position, steric hindrance would rear its head, frustrating scale-up plans. A small tweak, big effect. After seeing projects stall over such nuances, I’ve come to appreciate molecular details in a way textbook charts never capture.

    Among esters of benzoic acid, this compound stands out because the bromo group unlocks cross-coupling applications, and the placement of the methoxy group opens or closes doors to specific synthetic challenges. Whether someone works in drug development or material science, the trifecta of reactivity, selectivity, and scalability puts this molecule in a practical sweet spot.

    What Does 98% Purity Mean for the End User?

    High purity isn’t just about ticking a box. Over the years, I’ve watched teams troubleshoot stuck reactions, strange yields, or unexpected toxicities, only to discover the culprit: impurities that crept in unnoticed. In this context, the 98% grade behaves like insurance. Each percentage point above 95% means less guesswork and more predictable outcomes. This matters most in regulated environments where downstream impurities can threaten a drug candidate’s profile, or in scale-up campaigns where variability means lost revenue.

    Impurities, even ones that seem trivial at first, can snowball through synthetic routes. They might introduce hard-to-remove byproducts, raise safety issues, or contaminate analytical test results. In my experience, investing in higher purity up front pays off by cutting down on costly purification steps and reducing quality control headaches later on. Colleagues in pilot plants and quality teams often echo these sentiments—“buying cheap is buying twice.”

    How Regulations Shape Market Expectations

    Working in regulated industries comes with its host of anxieties and demands. Traceability, documentation, and solubility data sometimes trump price. Regulatory agencies want to see well-characterized materials with data to back up every claim. They aren’t just being fussy; these requirements stem from real-world crises, recalls, or contamination scares. Methyl 3-Bromo-4-Methoxybenzoate 98, meeting a tight assay, aligns better with these expectations, simplifying batch documentation and easing passage through analytical review.

    A few years ago, a regulatory auditor flagged a project for using an intermediate of unknown purity. Even though it ended up “safe,” the paperwork and stress lasted for months. With well-established materials like this methyl ester, the documentation stack is easier to maintain. Reliable sourcing, accompanied by robust analytical data, lets labs operate with a lower risk of audit-induced migraines.

    Real-World Challenges: Sourcing and Scalability

    Sourcing high-quality intermediates sometimes feels like an obstacle course. Small suppliers can come and go, or batch variation creeps in because of overlooked process drift. I’ve seen organizations run into delays when batches didn’t meet expectations, scrambling for last-minute replacements or emergency purifications. With a compound as commonly used in medicinal chemistry as this methyl ester, continuity of supply is more than convenience—it keeps research on schedule and in compliance.

    Scalability depends on predictable physicochemical properties. Melting point, solubility, and thermal stability each influence how a compound performs from the flask to the kettle. The methyl 3-bromo-4-methoxybenzoate structure strikes a workable balance. It dissolves in organic solvents often used in pharmaceutical labs, and its boiling point allows for manageable processing. Differences compared to other benzoates, such as increased reactivity from the bromo group or enhanced electron donation from the methoxy, change how scale-up experts design reaction conditions and purification methods.

    Application Expansion: From Pharma to New Materials

    It’s not just drug labs using this methyl ester. Peptide and materials chemists sometimes rely on it as an entry point for introducing tailored functionalities. The methoxy and bromo handles lend themselves to modifications that expand a molecule’s electronic properties—important in electronics or sensor development. Academic groups, drawn by robust literature on its reactivity, incorporate it into teaching labs and exploratory projects.

    One project I followed in a materials science context used this molecule to install a functional group that changed polymer color under specific stimuli. The bromo group made the installation step efficient, sparing researchers from harsher alternatives that degraded yields. The flexibility of the structure finds echoes in countless scientific papers, speaking to its broad appeal.

    Pitfalls and Quality Control Traps

    Even the best compounds can throw curveballs. This benzoate can suffer from batch-to-batch inconsistencies if stored poorly or exposed to moisture. Hydrolysis produces methyl 3-bromo-4-methoxybenzoic acid—a subtle shift that can play havoc with carefully tuned synthetic routes. Colleagues in quality control often test incoming lots as a matter of routine, nipping such issues in the bud. In fast-moving projects, skipping this step can cost weeks as teams troubleshoot inexplicable failures.

    I know teams who have installed secondary controls—a checkpoint GC analysis upon receipt and before each use. Small investments like this catch surprises early, which, over multiple campaigns, preserves both reputation and results. Given the stakes, most teams consider such diligence just part of the job.

    Cost Versus Performance: Is Premium Worth It?

    Every project runs into the “can we use a cheaper alternative” discussion. In the short term, it’s tempting, especially in cash-strapped startups or academic groups. Yet, in my experience, lower-cost grades with marginally higher impurity loads result in a trail of additional purification efforts, lost time, and declined reproducibility. The up-front price of 98% grade ends up being modest compared to the downstream risk mitigation and reduced troubleshooting.

    In pharmaceutical or agrochemical pipelines, tight timelines and regulatory demands leave little tolerance for compromised intermediates. The purity and reactivity profile of methyl 3-bromo-4-methoxybenzoate keeps it competitive, even in tight markets. I’ve seen teams write-off a few hundred more spent on premium intermediates as “insurance,” especially as projects scale and small uncertainties become major cost drivers.

    Potential Solutions to Sourcing and Process Challenges

    Maintaining reliable supplies and consistent quality emerges as a core issue. Teams that benefit most from methyl 3-bromo-4-methoxybenzoate often foster relationships with reputable vendors, balancing periodic quality checks with long-term agreements. Larger organizations sometimes assign “champions” to key intermediates: people accountable for monitoring spec deviations or sudden supply disruptions.

    From a process improvement perspective, investing early in robust QC frameworks pays off. This encompasses not only checking purity, but also confirming reactivity, solubility, and even subtle contaminants that earlier-stage projects might ignore. Small tweaks to customs clearance, batch documentation, or internal verification protocols can shave days off timelines—especially in international ventures.

    For academic labs or smaller start-ups lacking resources for exhaustive QC, collaboration with partner organizations or local consortia offers a way forward. Sharing analytical capabilities, and keeping backup suppliers on call, helps prevent project halts tied to a single lot failure. Colleagues pooling LC/MS or NMR tools have saved more than one project relying on hard-to-source intermediates.

    The Path Ahead: Complex Molecules and Growing Demands

    The push for new drugs, advanced materials, and smarter sensors keeps demand for reliable, adaptable intermediates on the upswing. Methyl 3-bromo-4-methoxybenzoate 98 fits this need: structurally flexible, robust in processing, and compatible with the leading synthetic methodologies. As expectations around traceability, documentation, and regulatory compliance grow, the premium on well-characterized intermediates only increases.

    I’ve seen the field evolve over the years, from makeshift syntheses using uncertain starting points to streamlined, scalable campaigns anchored by a handful of trusted intermediates. This methyl ester, by meeting those modern standards, keeps project momentum high and documentation manageable. The journey from lab to production floor remains full of challenges, but with the right building blocks, chemists and innovators face fewer detours along the way.

    Final Thoughts on Methyl 3-Bromo-4-Methoxybenzoate 98

    Reliable chemical intermediates build the backbone of innovation across pharma, agriculture, and materials science. Methyl 3-bromo-4-methoxybenzoate, at a high purity, gives researchers, engineers, and developers a solid foothold for moving work from curiosity-driven exploration to commercial reality. Its nuanced differences from similar compounds shape what’s possible in synthesis, and its consistent performance marks it as a compound worth considering in any serious project roster.

    The sharpest teams don’t simply settle for “good enough.” Instead, they seek out materials that give both flexibility and a known track record. In a crowded marketplace where progress depends on a hundred interdependent choices, picking a robust, reliable building block often sets the direction—and the pace—for the rest of the journey.