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2-Bromo-1-Methyl-1H-Imidazol-4,5-Dicarboxynitrile

    • Product Name 2-Bromo-1-Methyl-1H-Imidazol-4,5-Dicarboxynitrile
    • Alias 2-Bromo-4,5-dicyano-1-methylimidazole
    • Einecs 859-349-1
    • 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
    Specifications

    HS Code

    748686

    Productname 2-Bromo-1-Methyl-1H-Imidazol-4,5-Dicarboxynitrile
    Casnumber 54541-86-3
    Molecularformula C6H3BrN4
    Molecularweight 223.02 g/mol
    Appearance Off-white to pale yellow solid
    Solubility Slightly soluble in organic solvents
    Purity Typically >98%
    Storageconditions Store at 2-8°C, in a tightly sealed container
    Smiles Cn1c(C#N)c(C#N)nc1Br
    Inchi InChI=1S/C6H3BrN4/c1-11-4(2-8)5(3-9)10-6(11)7/h1H3
    Synonyms 1-Methyl-2-bromo-4,5-dicyanoimidazole
    Usage Pharmaceutical intermediate

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    More Introduction

    2-Bromo-1-Methyl-1H-Imidazol-4,5-Dicarboxynitrile: A Closer Look at a Specialty Compound

    Chemistry opens the door to a staggering array of complex molecules, and with each new structure, researchers and manufacturers gain access to possibilities that often transform markets and labs alike. One such example is 2-Bromo-1-Methyl-1H-Imidazol-4,5-Dicarboxynitrile, a substance arising at the intersection of thoughtful synthesis and real-world demand. Through every stage—production, shipping, and use—details matter for specialists seeking purity and consistency.

    Unique Structure, Specific Purpose

    The backbone of this molecule—a bromo-substituted imidazole with dicarboxynitrile groups—marks it as more than just a curiosity. Subtle shifts in structure influence downstream chemistry, which gives this compound its standing. Unlike standard benzimidazoles or generic dinitriles, the strategic placement of the bromine atom and methyl group brings out distinct reactivity. Chemists who step into organic synthesis quickly recognize that such tailored molecules often drive innovation in pharmaceuticals, agrochemicals, and material science.

    In the lab, reactions involving 2-Bromo-1-Methyl-1H-Imidazol-4,5-Dicarboxynitrile frequently center on its dual nitriles and halogenated ring. These features encourage coupling, cyclization, or even halogen-lithium exchange, opening up routes to heterocycles or aromatic frameworks that other starting materials may block. The presence of both electron-withdrawing and electron-donating sites on a single scaffold means tailored reactivity for those looking to build more than what’s found in base catalogues.

    Specifications that Matter to Chemists and Manufacturers

    Working with imidazole derivatives can be challenging, especially when trace impurities and moisture impact outcomes. The best sources of 2-Bromo-1-Methyl-1H-Imidazol-4,5-Dicarboxynitrile pay close attention to parameters like chemical purity—measured by HPLC or NMR—often pushing well above the 98% mark for research applications. That degree of care matters, since side products from incomplete bromination or subpar nitrile groups bring headaches in chromatography or late-stage reactions.

    Grain size, color, and batch consistency all play into how smoothly things run in a bench-top flask or production vat. Lower-end supplies can introduce colored byproducts or uneven crystallization, sometimes derailing downstream transformations. More refined sources aim for a white to off-white powder, free-flowing and easy to weigh, with melting points and solubility ranges checked lot by lot—not just in catalogues.

    Scientists and technicians always look for analytically supported documentation—NMR, IR, and MS data help in confirming purchased goods. The best manufacturers keep their supporting documents transparent, recognizing that trust in an unknown crystalline sample begins with access to verification. For large-scale synthesis, lot size and reproducibility trump nearly every other feature, as bench-scale success often fizzles without scalable sourcing that keeps impurity levels right on target.

    Comparing to Related Imidazole Derivatives

    Not every imidazole shares the same capabilities. The addition of two nitrile groups at the 4 and 5 positions, combined with a methyl at the 1 and a bromine at the 2, distinctly separates this compound from the more basic 1-methylimidazole or 2-bromoimidazole—the chemistry simply doesn't track across the class. Substituent patterning impacts things like solubility, reactivity with nucleophiles, and even safety considerations in storage. While plain bromoimidazoles may serve as halogen sources, the extra nitriles open up coordination chemistry possibilities, among others.

    Take functional group compatibility as an example. During complex molecule synthesis, the avid reactivity of the dicarboxynitrile positions means they pair well with nucleophiles or transition metal catalysts, delivering pathways not easily accessed with plainer imidazoles. The bromo group, for instance, makes this compound ideal for palladium-catalyzed coupling—a tactic that often stalls with protected or unsubstituted rings.

    This molecular tuning carries through to formulation; compounds like 1-methyl-1H-imidazole may dissolve more easily but miss the reactivity window that the additional groups open. Isolation, cleanup, or further modification of the dicarboxynitrile derivative rarely follows playbooks built for simple aromatics. In practice, that complexity is an asset for teams who look to create APIs or intermediates with endpoints far beyond the basics.

    Why Chemists Care About 2-Bromo-1-Methyl-1H-Imidazol-4,5-Dicarboxynitrile

    Every time I’ve run a synthesis requiring specialized building blocks, the choice of starting material tells half the story. In my experience, skewing toward a compound with pre-installed reactivity—like 2-Bromo-1-Methyl-1H-Imidazol-4,5-Dicarboxynitrile—often means fewer steps to a finished product. Worse, picking the wrong precursor leaves teams sorting through impurities for weeks, crossing their fingers that a key intermediate won’t crash out as an oil or push NMR time past the week’s end.

    This substance saves cycles by packing electrophilic and nucleophilic sites onto a single ring. I’ve seen the nitrile positions snap up amines or alcohols, giving access to everything from synthetically valuable tetrazoles to more peculiar bicyclic frameworks. Research groups working on kinase inhibitors and enzyme blockers find that the scaffold’s rigidity, plus its mix of hydrogen bond acceptors, fits into binding pockets with a flexibility that few other compounds muster. Having pushed late-stage diversification on similar imidazole derivatives, I’ve watched teams hit brick walls with lesser substitutes, only to breeze past problems with the right compound in hand.

    Pharmaceutical and fine chemical companies don’t just buy “intermediates”—they look for reliability, documentation, and proven track records. A product’s history of being safely handled, shipped without degradation, and synthesized consistently goes further than a big name or glossy catalog claim. Batch-to-batch reproducibility determines who stays a trusted supplier, especially when multi-step synthesis string together yields that can’t drop without blowing budgets or study timelines.

    Role in Synthesis and Research

    Most of the novel targets that emerge from academic journals tie their success back to the integrity of starting reagents. There’s no shortcut around that. For 2-Bromo-1-Methyl-1H-Imidazol-4,5-Dicarboxynitrile, each nitrite or bromo atom does more than decorate the structure: each one guides the molecule down specific pathways, whether toward substitution, addition, or cyclization. Modern medicinal chemistry rarely follows a one-size-fits-all recipe, and pure, consistent intermediates like this one keep failures at bay.

    Lab stories abound of half-finished syntheses blown wide open by a single impurity—a misplaced methyl group, a missing double bond—not to mention the awkward step where an otherwise ideal intermediate never makes it through column chromatography in quantity. The chemists sourcing this particular compound aren’t buying a generic bottle; they’re investing as much in years of process validation as in the glassware on their shelves.

    Some research programs ride on small differences. In fragment-based drug discovery, where every additional nitrogen or halogen can change an inhibitor’s fate, placing a bromo or methyl at just the right spot swings binding affinity by orders of magnitude. Colleagues in chemical biology keep these molecules on hand not just for primary screens but for structure-activity relationship deep-dives—every substitution gets tested, every available precursor gets scrutinized down to purity and certification paperwork. In my own work on enzyme modulation, even a single missed impurity spelt days wasted running dead-end TLCs, underscoring why traceability and documentation matter so much.

    Safety, Handling, and Real-World Use

    Bringing specialized intermediates into a working lab always stirs questions; safety follows chemistry at every stage. The presence of a bromo group means this compound handles like other halogenated intermediates—gloves, good ventilation, and secure storage are standard. The dicarboxynitriles, familiar from acrylonitrile and related relatives, raise flags for toxicity if mishandled or processed at scale. The difference is always in the details: careful labeling, controlled weighing, and shared protocols among all team members handling the compound.

    Material safety doesn’t end at storage. Disposal protocols for halogenated organics, especially those containing nitriles, need to be up to speed. In my experience, labs that cut corners or drop the ball on solvent clean-up see regulatory and compliance headaches build up alarmingly fast. The best suppliers back up their products with not just technical data but practical recommendations, from suggested compatible solvents to temperature thresholds for reactions. Many research teams pass these insights along informally, building challenges and shortcuts into the training for every new chemist joining the bench.

    Sourcing, Documentation, and the Role of Quality Control

    Reliable chemical sourcing remains a challenge, given the explosion of global suppliers and rapidly shifting regulatory frameworks. I’ve seen the damage done by inconsistent supply—unexpected delays, lost batches, and tens of thousands down the drain in wasted labor. For 2-Bromo-1-Methyl-1H-Imidazol-4,5-Dicarboxynitrile, quality hinges on things that don’t always make it onto the sales pitch: spectrographic validation, written CoAs, and actual customer feedback.

    Labs that value transparency tend to hold the upper hand. Cross-checks with NMR, IR, or LC-MS, against trusted standards, have prevented more disasters than most realize. One researcher may recall a shipment with an off-white tinge—sure enough, further testing found the culprit was an incompletely resolved side product from the original bromination reaction. Others recount nearly perfect batches, each vial matching a barcode-logged record, with spectra clear as a bell and proof of storage conditions from synthesis to the receiving dock.

    In my own projects, having assurance that each lot fits the published analytical profile reduces headaches and cuts risk. Surprises in batch purity disrupt timelines and frustrate collaborators expecting reproducibility in multi-center studies. Standardization—far from being bureaucratic ritual—makes the difference between a competitive program and a project set back months by irreproducibility.

    Facing Challenges in Commercial and Academic Use

    No chemical arrives in a vacuum; companies and universities alike face shifting rules, environmental standards, and reporting requirements. Imidazole derivatives with halogen and nitrile substituents sometimes run afoul of regulatory agencies due to their potential toxicity and environmental persistence. Thorough documentation and up-to-date safety records keep operations on the right side of these hurdles. Several years ago, a missed reporting deadline almost brought a promising project to a halt simply due to a backdated certificate of analysis. From then on, our group double-checked all incoming intermediates for clear, compliant paperwork.

    Handling and training can make or break lab safety records. Most labs circulate new safety sheets and offer formal orientation before handing off unfamiliar compounds. Some labs go further, running in-house analytics before approving the use of non-domestic suppliers. Having multiple eyes on each step pays dividends, particularly in high-risk, grant-funded environments where turnover and training gaps risk exposing teams to hazardous missteps. A teaching lab’s miscalculation on dosage almost caused a runaway exotherm—a simple double-check of the supplier’s recommended addition rate prevented disaster.

    Looking for Solutions and Improvements in the Field

    Improvements start with open communication between buyer and supplier. Scientists who keep in touch with manufacturers, sharing feedback and requesting batch data, help establish a culture of continuous improvement. Dedicated feedback channels allow labs to flag subtle quality shifts before they evolve into chronic supply problems. During a particularly tense supply chain pinch, I saw a team of researchers pool orders to demand a shipment that matched strict new documentation requirements—blocking substandard product from entering their workflow.

    On a technical level, tracking trends in synthetic routes, greener solvents, and more robust purification protocols always runs parallel to product innovation. The chemical industry has begun implementing more automated chromatographic systems and inline analytics, pushing reproducibility and lot matching higher than ever. I once visited a contract manufacturing facility that adopted real-time NMR and HPLC checks across major product lines. Their defect rate dropped, and recall events all but vanished over a two-year span. Forward-thinking suppliers of 2-Bromo-1-Methyl-1H-Imidazol-4,5-Dicarboxynitrile find that these practices attract the top buyers—those who value science and safety in equal measure.

    Why 2-Bromo-1-Methyl-1H-Imidazol-4,5-Dicarboxynitrile Holds Lasting Value

    Every generation of researchers brings fresh eyes to well-trod problems. For projects in medicinal chemistry, agrochemicals, and material science, small shifts in molecular structure still drive major innovations. 2-Bromo-1-Methyl-1H-Imidazol-4,5-Dicarboxynitrile carves out a place in this landscape. As a starting point for cross-couplings and derivatizations, the compound offers more than commodity-grade benefits. It delivers a tested, reproducible path to advanced targets, especially in areas where regulatory, purity, and safety issues rule out less well-documented intermediates.

    My years in research and industry have shown that the difference between success and failure often rests on the reliability of supplies, the depth of documentation, and the clarity of communication at every link in the supply chain. Changing the conversation between chemists and manufacturers—moving beyond price toward performance, support, and process transparency—ultimately raises standards for everyone. In that sense, compounds like 2-Bromo-1-Methyl-1H-Imidazol-4,5-Dicarboxynitrile become more than tools. They represent a collaborative pursuit for not only cleaner, more effective science but also a safer, more responsible approach to crafting the chemicals that power discovery.

    Recommendations for Navigating the Market

    Start with references. Seek out labs and vendors who document client feedback and stand by their quality commitments. Flawed batches and inconsistent handling costs time and credibility. Keep analytics front and center—not just when problems hit, but as a regular step in the intake process for all specialty chemicals. Ask suppliers for up-to-date spectra and CoA with each shipment, and keep records for every vial that arrives. Insist on transparency from your vendors; a strong supplier relationship comes from shared accountability for outcomes.

    Continue investing in internal training and cross-checks. Share stories and findings within your organization, making sure everyone understands the specifics of the compounds brought into your workflows. The most successful teams I’ve seen sustain a culture of shared vigilance, trading tips and pitfalls not only to meet compliance or yield, but to foster professional pride. We all benefit when best practices become common knowledge—and when those extending beyond legal mandates become daily routines.

    Stay current with changing industry standards. Regulatory deadlines and purity benchmarks move fast. Organizations that track these shifts, updating protocols as needed, consistently outperform those who react only when problems break through. Get out ahead of regulatory inspections, making sure audit trails and safety information remain complete and accessible at all times. That foundation—built on clear communication and consistently meticulous documentation—lets innovative chemistry flourish.

    The Road Ahead

    As specialty chemistry drives new frontiers, thoughtfulness in sourcing, handling, and documentation grows by necessity. Every difficult synthesis, every regulatory filing, every successful batch can be traced back to everyday choices about materials and protocols. 2-Bromo-1-Methyl-1H-Imidazol-4,5-Dicarboxynitrile stands as an example—a compound that both challenges and rewards careful practice. Labs that invest in thorough validation, rigorous safety, and open collaboration find themselves best positioned to thrive in a field where margins are thin, expectations exacting, and the room for failure grows smaller by the year. The future may bring more complex molecules and tighter oversight, but at its core, sound science and consistent quality remain the most valuable assets on any bench or balance sheet.