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Ethyl 4-Bromo-3-Fluorobenzoate

    • Product Name Ethyl 4-Bromo-3-Fluorobenzoate
    • Alias 4-Bromo-3-fluorobenzoic acid ethyl ester
    • Einecs 849-096-6
    • 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

    539550

    Chemicalname Ethyl 4-Bromo-3-Fluorobenzoate
    Casnumber 142752-74-6
    Molecularformula C9H8BrFO2
    Molecularweight 247.06 g/mol
    Appearance Colorless to pale yellow liquid
    Boilingpoint 275-277°C
    Density 1.524 g/cm3
    Purity Typically ≥98%
    Solubility Slightly soluble in water, soluble in organic solvents
    Smiles CCOC(=O)C1=CC(=C(C=C1)Br)F
    Inchi InChI=1S/C9H8BrFO2/c1-2-13-9(12)5-3-4-7(10)8(11)6-5/h3-4,6H,2H2,1H3
    Refractiveindex 1.541
    Storageconditions Store at room temperature, keep container tightly closed
    Hazardclass Irritant

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    More Introduction

    Ethyl 4-Bromo-3-Fluorobenzoate: Looking Closer at a Distinctive Chemical Building Block

    An Introduction Rooted in Real-World Chemistry

    Ethyl 4-Bromo-3-Fluorobenzoate has quietly moved into the spotlight in recent years, especially for those of us working where organic synthesis demands specialized tools. Getting to know this compound means looking at what makes it genuinely different—its structure, the qualities each part of its molecule offers, and the advantages it brings to challenging chemical tasks. The formula alone, C9H8BrFO2, already hints at how a simple benzoate core meets with bromine and fluorine atoms in places that can shift a reaction in one direction or another. Here in the lab, such choices never happen by chance. The usefulness of Ethyl 4-Bromo-3-Fluorobenzoate shows up in more than textbook diagrams; it comes alive in the middle of real work, where new drugs need a starting scaffold or agrochemical research traces out pathways toward safer, more effective solutions.

    What the Name Tells Us

    With so much jargon crowding the world of fine chemicals, taking apart the name sheds light on why chemists care:

    Put together, these features allow the product to stand out in scenarios where a different substitution pattern on the benzene would fall short. Those of us who have tried to swap out a fluorine or bromine know it’s not just shuffling Legos; subtle shifts in position can mean the difference between a pure product and a tarry mess.

    Where It Fits: Uses in Laboratories and Industry

    In the pharmaceutical sector, Ethyl 4-Bromo-3-Fluorobenzoate provides an anchor point for weaving new molecular designs. Medicinal chemists prize it because they can introduce both electron-withdrawing and electron-donating groups elsewhere on the ring, allowing for rapid exploration of structure-activity relationships. The fluorine, sometimes thought of as a molecular mimic for hydrogen, can nudge a compound’s ability to cross cell membranes, change how enzymes recognize a molecule, or even toughen it against metabolic breakdown. I’ve seen work where swapping in a fluorine atom at exactly this spot improves the chance of a new drug surviving long enough to matter in the body.

    Bromine’s role in cross-coupling reactions supports the construction of biaryl frameworks, the backbone for molecules as diverse as painkillers and pesticides. Where some aryl bromides might lag due to steric hindrance or less-activated rings, the position and combination found in Ethyl 4-Bromo-3-Fluorobenzoate offer a sweet spot—reactive enough to proceed smoothly, robust enough to manage the next steps in a multi-stage synthesis.

    For agrochemical research, small tweaks to the aromatic ring can give rise to entirely new modes of action. Even a minor shift in the pattern of halogenation—like switching the bromo or fluoro groups to opposite ends—can mean a world of difference in how a plant or insect processes a potential active ingredient. Over the years, researchers have found themselves reaching for this compound as a starting material for new herbicides or insecticides. The predictable reactivity and moderate molecular weight make it a sensible building block.

    The Working Life of a Useful Intermediate

    Those of us spending years at the benchtop come to recognize the value of a reagent as much by how it behaves at scale as by what it can do on paper. Ethyl 4-Bromo-3-Fluorobenzoate rarely throws surprises. It brings a combination of volatility, manageable melting point, and solubility in common organic solvents—acetone, dichloromethane, and others. This reliability matters, especially when a small screw-up at kilogram scale can cost weeks of lost effort and thousands in wasted raw materials.

    In larger processes, the compound demonstrates a sturdy shelf life when sealed against the moisture. Left open for too long, all organic esters can entice a bit of hydrolysis—yet compared to more delicate or oxygen-sensitive intermediates, this molecule gives operators an easier time. Care in handling pays off with decent yields and cleaner crystallizations.

    In my own experience, there’s a kind of reassurance in returning to intermediates with this pattern. The balance of performance and safety helps teams keep projects on track, especially under pressure to deliver tangible milestones for clients or stakeholders.

    Direct Competition: Standing Out from Related Compounds

    It helps to know the neighbors. Ethyl 4-Bromo-3-Fluorobenzoate shares its landscape with other halo-substituted benzoates, and while they all carry their own quirks, the particular arrangement here often propels it to the front of the line. For comparison, Ethyl 4-Bromobenzoate lacks the fluorine, missing out on the extra electron-withdrawing oomph that can push certain reactions just a bit further. Ethyl 3-Fluorobenzoate, missing the bromine, falls short for constructing biaryl systems directly.

    Each substitution pattern brings its own reactivity, toxicity, and sometimes regulatory standing. The ability to precisely dial these factors in offers a chemist a flexible toolkit, and this compound lands at a strategic point: not so reactive as to cause trouble, not so sluggish as to demand extreme conditions. From my work with small startups and university groups, the product’s balance of reactivity and stability wins trust for everything from pilot studies to patent-focused program launches.

    Reliable Quality and Specifications Matter

    Consistency underpins trust in specialty chemicals. Ethyl 4-Bromo-3-Fluorobenzoate tends to come as a crisp, off-white to pale-yellow solid, usually above 98% purity by HPLC or GC in reputable lots. Trace impurities—small traces of other isomers, or residual acids from synthesis—can complicate downstream processes, so proper sourcing and batch testing become essential in serious research environments. Spectroscopic data (NMR, IR, MS) play a pivotal role in confirming identity and purity; any chemist worth their pipette glances at the spectra before risking contaminating a multistep reaction train.

    Solid samples generally store well in amber glass, away from strong acids or bases. Because benzoate esters sometimes catch the eye of customs agencies or regulatory bodies, including a full certificate of analysis and chain-of-custody documentation not only signals professionalism, but also supports compliance in tightly monitored industries.

    Companies focusing on pharmaceutical intermediates know the regulatory map well. Early knowledge of solvent residuals, possible allergens or sensitizers, and trace metal content can head off last-minute headaches at the point of regulatory filings or clinical batch production.

    Impact on Green Chemistry and Sustainable Sourcing

    The last decade has changed how many look at fine chemicals: supply chain transparency, sustainability, and waste management all sit high on the list. Ethyl 4-Bromo-3-Fluorobenzoate reflects these shifts in small but tangible ways. Synthesis routes have started moving toward “greener” bromination and fluorination procedures, for instance using recyclable catalysts or reducing dependency on harsh, petroleum-derived solvents. Selective modern methods often focus on minimizing side-product formation, cutting purification steps, and thus lowering the energy footprint per kilogram produced.

    Waste products from older synthesis methods—polyhalogenated byproducts, for example—can pose headaches for disposal. Many producers now provide environmental impact statements on request, showing a clearer chain of responsibility. In my role supporting environmental compliance, I’ve found that working directly with suppliers willing to share full lifecycle data pays off in credibility and keeps projects from bogging down in audits.

    For buyers aligned with sustainability, the compound’s performance allows for lower reaction temperatures and avoids the need for overly aggressive reagents, which further limits downstream hazards and processing waste.

    Handling and Personal Safety Insights

    Day-to-day use of Ethyl 4-Bromo-3-Fluorobenzoate falls well within the skill set of both undergraduate teaching labs and senior development teams. While not presenting acute toxicity risks in the same category as organophosphorus or cyanide intermediates, the compound deserves respect. Like most aromatic esters with halogen substituents, glove and goggle use is standard, as the raw solid and dust can irritate skin and eyes.

    I’ve seen spills and splashes come from the most careful practitioners; prompt cleanup with inert absorbents and good ventilation makes all the difference. A few cases of inhalation during large-scale powder transfers reminded me of the value of proper mask use. The smell, while not overpowering, tends to linger—a veteran chemist once described it as “sharp and not quite like anything else, but not unpleasant if you’re used to synthetic organics.” Any reports of headache or irritation merit a pause and a double-check of the fume hood flow or ambient air quality.

    On the regulatory front, most shipments cross borders with the usual paperwork—MSDS, transport classification, and batch-specific documentation. Warehousing in cool, dry storage, with secondary containment, generally forestalls any secondary hazards.

    Pricing, Availability, and Supply Chain Reflections

    Anyone sourcing Ethyl 4-Bromo-3-Fluorobenzoate in the past few years has likely noticed fluctuations in price and availability, partly tied to realignment of manufacturing hubs and interruptions in global shipping. A well-planned project must factor in reliable suppliers with a track record of on-time delivery and transparency about lead times. In smaller markets, stockouts and delays can derail timelines, while larger distributors may benefit from inventory smoothing practices. In cases where projects use up dozens of kilograms per month, maintaining a buffer stock helps insulate teams from sudden price shocks.

    Smaller research projects juggle cost and quality, sometimes tempted by lower-cost suppliers. In practice, inconsistent purity often erases any savings, leading to repeated re-syntheses or failed reactions downstream. The lesson from years of research management is consistent: verify sources, check documentation, and keep lines of communication open with trusted suppliers.

    Potential Solutions to Common Challenges

    Many issues around the use of Ethyl 4-Bromo-3-Fluorobenzoate reflect broader patterns in specialty chemicals. Impurities in the starting material can cascade into more complex mixtures in downstream chemistries, amplifying separation challenges later. Tightening up on vendor audits, increasing the frequency of spot-checks with in-house analytics, and building relationships with labs that offer independent certification all boost confidence. Advances in purification—better chromatography, for example—let even mid-scale operators improve yield and speed.

    For those grappling with waste minimization, solvent choices, and “greener” procedures, adopting integrated waste management plans has started to pay off. Rather than simply neutralizing or dumping spent solvents, many labs now contract with recyclers or reclaimers, turning what used to be a cost into a sellable byproduct. As for handling safety, keeping on top of PPE use and routine space cleaning stands out as a low-effort, high-impact intervention—never glamorous, always essential.

    For global companies or university departments tasked with hitting grant milestones, building resilience in the sourcing chain might involve dual suppliers, periodic batch qualification, or partnering with manufacturers invested in digital tracking and transparent documentation. My recent experience with an international collaboration drove home how vital these relationships become under time pressure. A few days of extra planning has saved both money and embarrassment.

    Taking the Long View in Chemical Research

    What distinguishes Ethyl 4-Bromo-3-Fluorobenzoate isn’t any one headline-grabbing feature but a combination of reliability, flexibility, and compatibility with a landscape of modern chemical needs. Its nuanced position in the catalogue of fine chemicals makes it a favorite among bench chemists, scale-up managers, and QC analysts alike. From advancing pharmaceutical pipelines to enabling more sustainable manufacturing, the compound supports work at the interface of science and innovation.

    Those paying attention to details—batch tracking, analysis, regulatory support, and environmental reporting—find the product aligns well with new expectations for transparency and responsibility across the industry. Decades of careful improvements in synthesis, supply, and application ensure it continues finding a home in both established and cutting-edge projects. With every change in the field, Ethyl 4-Bromo-3-Fluorobenzoate manages to hold its own among a crowded shelf of similar-sounding compounds, proving again that subtle differences carry major weight where it counts.