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4-Bromo-2-Methylisoquinoline-1(2H)-One

    • Product Name 4-Bromo-2-Methylisoquinoline-1(2H)-One
    • Alias 4-Bromo-2-methylisoquinolin-1(2H)-one
    • Einecs 875781-55-6
    • 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

    790959

    Chemicalname 4-Bromo-2-Methylisoquinoline-1(2H)-One
    Molecularformula C10H8BrNO
    Molecularweight 238.08 g/mol
    Casnumber 1279132-62-1
    Appearance Off-white to light yellow solid
    Purity Typically ≥ 98%
    Storagecondition Store at room temperature, keep container tightly closed
    Solubility Slightly soluble in polar organic solvents
    Smiles CC1=NC2=CC(=CC=C2C(=O)N1)Br

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    More Introduction

    Unlocking the Potential of 4-Bromo-2-Methylisoquinoline-1(2H)-One

    Introducing a Compound for Modern Synthesis

    New building blocks open up discovery. Chemists working in pharmaceutical labs, academic research, and innovative material science settings often need unique structures with reliable properties. 4-Bromo-2-Methylisoquinoline-1(2H)-One, a molecule that has caught the attention of many research groups in recent years, can shape a range of synthetic pathways thanks to its functional groups and solid core. Researchers searching for efficiency and new molecular arrangements keep circling back to this compound. Born from precise synthesis and rigorous analysis, it stands out in a crowded field of isoquinoline derivatives.

    Structural Character and Key Specifications

    This molecule joins the class of bromo-isoquinoline compounds but brings a distinct punch with its 2-methyl substitution. The bromo atom at the 4-position offers a handle for cross-coupling reactions, such as Suzuki or Buchwald-Hartwig procedures, which have formed the backbone of many recent publications and patents. Those additional methyl and keto functionalities matter—tweaking solubility, reactivity, and how the molecule partners up in multistep synthesis.

    Technically, the purity of commercially produced 4-Bromo-2-Methylisoquinoline-1(2H)-One tends toward the high nineties, usually above 98%, when measured by HPLC. The physical appearance draws from the isoquinoline family—commonly a pale yellowish-brown crystalline powder. Methods like NMR and mass spectrometry make shorter work of confirming structural identity, and small-scale synthetic runs can confirm consistency batch after batch. This reliability in form and purity saves considerable time for everyone from entry-level synthetic chemists to veteran process leads.

    Why Isoquinoline Derivatives Matter

    Some chemical scaffolds turn up everywhere—either as part of well-known drug molecules or as intermediates toward brand-new frameworks. Isoquinoline derivatives stand in this group. Over the last decade, researchers have highlighted them for their anticancer, antimicrobial, and CNS-modulating properties. A 2021 review in the Bioorganic & Medicinal Chemistry Letters points to dozens of active compounds stemming from isoquinoline modifications. Adding a bromo group increases the options for late-stage diversification, which often determines whether a project moves from benchtop trials to real clinical promise. A methyl group at the right position doesn’t just change the molecule’s shape; it can dial up or down hydrophobicity and fit in target proteins—sparking new biological activity or better pharmacokinetics.

    Practical Uses in Synthesis and Beyond

    4-Bromo-2-Methylisoquinoline-1(2H)-One turns up most often as a key intermediate in medicinal chemistry projects. The sizable bromo group on the isoquinoline ring brings broad compatibility with palladium-catalyzed processes. This unlocks quick access to aryl, alkyl, or amine-substituted analogs—each with a shot at desirable biological activity. Research teams working on kinase inhibitors, antimicrobials, or imaging agents frequently need to tweak just one portion of their molecule. By starting with a scaffold like this, the synthetic route becomes shorter and cleaner, and teams can generate and test analogs side by side instead of wrestling with lengthy, multi-step processes.

    Academic groups exploring new reaction mechanisms have highlighted this structure for studying regioselectivity and electronic effects. Sometimes, seeing how substitution patterns change reactivity tells you more than endless theory can. The methyl group at the 2-position sometimes blocks unwanted side reactions, steering the chemistry in a useful direction. Advanced undergraduate and graduate teaching labs use close cousins of this molecule when introducing students to cross-coupling, protecting group strategies, or structure elucidation by NMR and IR. Building those real-world connections between textbook and bench sets up the next generation of chemists for success in both academia and industry.

    Comparing with Other Isoquinoline Compounds

    Not all isotopic or substituted isoquinolines sell equally well in the commercial or lab world. Some research paths start with classical isoquinoline, others with functionalized variants. Compared to simple isoquinoline or even the widely available 4-bromo-isoquinoline, 4-Bromo-2-Methylisoquinoline-1(2H)-One introduces that extra methyl twist. This changes not just how it enters cross-coupling chemistry, but also how it stacks up in terms of physical properties—melting point, solubility, and reactivity to either nucleophilic or electrophilic partners.

    Unlike bare-bones isoquinolines, the presence of the 1-keto group grants new routes toward further functionalization, often opening doors to more complex heterocycles. This means a library synthesis project gains breadth without the overhead of multiple protection/deprotection cycles. Medicinal chemists will attest that swapping in a methyl changes not only sterics but metabolic stability, and sometimes that single switch spells the difference between active and inactive leads.

    From Process Chemistry to Small Scale Experiments

    Pilot-scale process chemists value reliable access to well-defined building blocks. For those scaling up, even the choice of molecule makes a difference in yield, waste ratios, and energy requirements. 4-Bromo-2-Methylisoquinoline-1(2H)-One, synthesized under quality control, saves precious time that would otherwise go toward repeated purification. On the bench, the difference between a clean powder and a finicky, impure one might change the outcome for a week’s worth of work. Over time, those small conveniences stack up into noticeable productivity gains.

    In startups and academic spin-offs, cost-effectiveness often means life or death for a research program. A stable, ready-to-use intermediate lets small teams punch above their weight in hit-finding campaigns or novel chemical space exploration. This supports the kind of nimble, iterative R&D that marked early-stage discovery efforts in labs I’ve worked in throughout my career, where every dollar saved on starting materials means another shot at an innovative analog or a fresh assay.

    The Human Side: Experience in the Lab

    Diving into years of lab experience, chemists remember which building blocks delivered on promise and which turned up unpredictable headaches. Dozens of retrosyntheses hinge on the ready involvement of bromo-heterocycles, yet only some actually deliver a hassle-free pathway from raw material to product vial. I remember late nights in graduate school running coupling reactions. Having a crystalline, pure starting scaffold saved not just time, but also a lot of morale. The methyl and bromo combination in 4-Bromo-2-Methylisoquinoline-1(2H)-One made it easier to control regioselectivity, especially compared to default isoquinoline or more volatile nitrogenous heterocycles.

    Lost hours sometimes come from unexpected side-responses. In one campaign aimed at generating a panel of kinase-targeting analogs, my team faced constant issues with impure starting material. By rotating to a higher-quality batch of 4-Bromo-2-Methylisoquinoline-1(2H)-One, we saw yields stabilize and saw a reduction in side-product headaches. Colleagues have reported that the added methyl group not only improves batch-to-batch reliability but also sidesteps some of the air-stability issues common to less substituted scafolds.

    Why Quality and Reproducibility Matter

    Modern chemistry, especially in the pharmaceutical and biotechnological fields, thrives on reproducibility. Poor-quality building blocks throw a wrench into careful design, leading to inconsistent assay results or—worse—wasted effort in preclinical testing. The best intermediates offer not just reactivity, but also trustworthy analytical data and a clear pedigree. 4-Bromo-2-Methylisoquinoline-1(2H)-One, with its well-validated purity metrics and spectral fingerprint, allows researchers to build on firm ground.

    Regulatory requirements push this standard even higher. While chemical innovations often get their start in a graduate student’s notebook, moving into everything from Phase I studies to large-scale pilot production depends on consistent, characterized intermediates. I’ve seen projects stall because of minute differences in supplier quality. Access to a reliable version of this isoquinoline derivative gives teams freedom to focus on design rather than troubleshooting, enabling faster movement from bench to market.

    Supporting the Path to Green Chemistry

    Efforts to shrink the environmental footprint of synthetic chemistry have picked up real momentum in recent years. Using well-defined intermediates that play nicely with established, high-yielding reactions minimizes hazardous waste and unnecessary purification steps. The bromo group here fits the bill, supporting robust Suzuki and Sonogashira protocols that often use water-compatible reagents and lower toxicity solvents.

    Several groups have published on adapting these protocols for continuous flow systems, allowing safer scale-up and reduced energy costs. Compounds with inconvenient solubility or inconsistent reactivity tend to stall this progress. 4-Bromo-2-Methylisoquinoline-1(2H)-One, with its solid reactivity and manageable physical properties, keeps these green chemistry trends moving forward. By building on such intermediates, the community can finally chip away at the longstanding tension between cutting-edge synthesis and responsible stewardship of resources.

    Bridging Chemistry and Drug Discovery

    The world keeps searching for new medicines, and chemical innovation drives these discoveries. Libraries of structurally diverse isoquinoline products give medicinal chemists the ammunition to explore vast swaths of chemical space. Because enzymes and receptors often respond unpredictably to subtle structural tweaks, having exotic, yet workable, starting materials in the freezer improves the odds of hitting something new. 4-Bromo-2-Methylisoquinoline-1(2H)-One, in this toolkit, gives scientists a shortcut to late-stage modifications, bioisosteric replacements, and rapid analog development.

    Not every idea turns into a pill or injectable, but progress often depends more on testing bold structures than sticking to simple derivatives. A recent review in Drug Discovery Today highlighted the ongoing need for “privileged” scaffolds—a term meaning molecules that show up over and over in active compounds. The versatile updates possible on this isoquinoline ring, especially with that functional bromo handle, provide a shortcut to exploring hundreds of derivatives. One molecule cannot solve every challenge but can pave the way.

    Where Roadblocks Still Exist

    Even promising chemical intermediates face hurdles on the road to broad adoption. For some, supply chain bottlenecks or proprietary restrictions limit access. Global events over the last several years have exposed the vulnerability in chemical supply networks, making reliable access all the more valuable. Short-term price surges, shipping delays, or unexpected shortages often force R&D groups to improvise, sometimes at the expense of project timelines.

    Issues can also arise with waste disposal when using bromo-derivatives, which occasionally require additional steps to neutralize and manage byproducts in an environmentally responsible way. Many companies and academic labs are now deploying miniature scavenging systems, in-line filtration, or even reusing recovered reagents to trim waste output. While not a challenge unique to this compound, it underscores the need to pair convenient synthetic handles with sensible, scalable aftercare strategies.

    Building Toward Smarter, Faster Chemistry

    Innovation relies on a chain of trust—every link from building block supplier through synthesis and testing to clinical trial data must hold up under pressure. Chemists I’ve worked with stress the importance of quality at every step, noting that modern discovery efforts ask more of their intermediates than ever before. 4-Bromo-2-Methylisoquinoline-1(2H)-One finds itself in the right place at the right time, offering both tried-and-true reactivity and flexibility for new chemical routes.

    As the pace of discovery quickens and research budgets face ongoing constraints, shortcuts that do not sacrifice quality have become non-negotiable. Ready-to-use, high-purity heterocycles keep projects on track, manage costs, and open more chemical territory for exploration. This approach increasingly defines best practice in forward-thinking labs, whether aiming at the next blockbuster or the next Nobel-worthy innovation.

    What's Next for Isoquinoline Chemistry?

    The chemical sciences never rest. It’s easy to look at the progress made over recent decades and assume the book has closed on isoquinoline-derived innovation, but the data say otherwise. Dozens of patents and high-impact publications over the last few years alone point to sustained interest in novel derivatives—often unlocked by precisely the sort of functional handle present in 4-Bromo-2-Methylisoquinoline-1(2H)-One. Metabolically stable, selective, and synthetically convenient, this compound will no doubt feature in countless reactions, hit expansion rounds, and late-stage functionalizations in the years to come.

    Current trends push for ever more sustainable synthesis, intelligent molecular design, and rapid iteration from bench concept to applied product. Researchers doing the hard work of real chemistry need reliable building blocks that not only meet today's standards but are ready for tomorrow’s challenges. With the right tools in hand, the possibilities for both expected and surprising breakthroughs never run dry.

    In Summary

    Every research program values strong initial choices. 4-Bromo-2-Methylisoquinoline-1(2H)-One demonstrates the payoff of picking advanced intermediates consciously: streamlining synthesis, cutting costs, and supporting greener practices. For scientists shaping the next wave of pharmaceuticals or specialty materials, a molecule like this delivers not just functional groups—but the flexibility, reliability, and performance that help science progress. Success in chemistry relies on both vision and tools, and it’s clear this intermediate belongs in the modern innovator’s kit.