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Isoquinoline-5-Boronic Acid

    • Product Name Isoquinoline-5-Boronic Acid
    • Alias 5-isoquinolineboronic acid
    • Einecs NA
    • 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
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    Specifications

    HS Code

    718698

    Productname Isoquinoline-5-Boronic Acid
    Casnumber 861388-25-0
    Molecularformula C9H8BNO2
    Molecularweight 171.98
    Appearance White to off-white solid
    Meltingpoint 235-239°C
    Purity Typically ≥ 97%
    Solubility Slightly soluble in water, soluble in organic solvents
    Smiles B(C1=CN=CC2=CC=CC=C12)(O)O
    Inchikey NLHJGQYVTYJMNU-UHFFFAOYSA-N
    Storagetemperature 2-8°C

    As an accredited Isoquinoline-5-Boronic Acid factory, we enforce strict quality protocols—every batch undergoes rigorous testing to ensure consistent efficacy and safety standards.

    Packing & Storage
    Packing Isoquinoline-5-Boronic Acid is packaged in a 5-gram amber glass bottle with a tamper-evident cap, clearly labeled for laboratory use.
    Shipping Isoquinoline-5-Boronic Acid is shipped in tightly sealed containers to prevent moisture and air exposure. It is typically packed under inert atmosphere and cushioned for protection against physical damage. Classified as a laboratory chemical, shipping complies with relevant chemical safety regulations, including labeling and documentation, ensuring safe and compliant transportation.
    Storage Isoquinoline-5-boronic acid should be stored in a cool, dry, and well-ventilated area, away from direct sunlight and sources of ignition. Keep the container tightly closed and store separate from incompatible substances such as oxidizing agents. Use appropriate chemical storage cabinets and ensure labeling is clear. Handle with gloves and eye protection to avoid direct contact.
    Application of Isoquinoline-5-Boronic Acid

    Applications of Isoquinoline-5-Boronic Acid in Industrial Manufacturing

    As an established manufacturer specializing in high-purity Isoquinoline-5-Boronic Acid, we supply this material mainly to advanced pharmaceutical, agrochemical, and specialty chemical sectors. Recognized for its distinct reactivity in C–C and C–N bond formations, this building block underpins high-value synthetic processes. Below we detail its practical integration into end-use manufacturing, corresponding to distinct industrial domains with full compliance transparency.

    1. Active Pharmaceutical Ingredient (API) Synthesis for Oncology Compounds

    API manufacturers utilize our material in multi-step Suzuki-Miyaura cross-coupling protocols to construct complex heteroaromatic oncology drug intermediates. The unique boronic acid functional group enables precise introduction of the isoquinoline motif, which is essential in several kinase inhibitor scaffolds. Downstream integration occurs during the late-stage synthesis step, demanding highest purity and trace metal control to safeguard bioactivity and meet regulatory filing requirements.

    Industry compliance standards

    • ICH Q7 Good Manufacturing Practice for Active Pharmaceutical Ingredients
    • United States Pharmacopeia (USP) relevant to drug substance intermediates
    • EudraLex Volume 4, EU GMP Guidelines
    • SFDA (China) Pharmaceutical Production Quality Management Standards

    Typical usage ratio

    • 0.9–1.2 molar equivalents relative to halogenated isoquinoline precursor; adjusted by desired yield and side product formation

    Downstream process integration

    • Introduced in the penultimate synthetic step as a coupling reactant under Pd-catalyzed Suzuki conditions, typically following protection/deprotection sequences

    Final product types

    • Small molecule kinase inhibitors (e.g., CDK, BTK, PI3K targets)
    • Investigational anticancer intermediates

    2. Development of Agrochemical Intermediates for Herbicide Synthesis

    Leading agrochemical producers employ Isoquinoline-5-Boronic Acid to introduce isoquinoline substructures into next-generation herbicidal actives through selective cross-coupling techniques. The process ensures controlled functionalization, supporting the production of complex intermediates that exhibit improved selectivity and reduced off-target activity. Material handling and dosing follow established stewardship standards to mitigate any risk in large-scale commercial operations.

    Industry compliance standards

    • FAO/WHO Specifications for Plant Protection Products
    • ISO 9001:2015 Certified Manufacturing
    • REACH Registration (EC No. 1907/2006) for imported intermediates
    • GLP (Good Laboratory Practice, OECD guidelines) for pilot-scale trials

    Typical usage ratio

    • 1.0–1.3 molar equivalents per target halogenated aromatic coupling partner, modulated by batch size and target impurity profile

    Downstream process integration

    • Dosed after solvent exchange step in the intermediate/final coupling reaction; temperature and pH carefully monitored to prevent boronic acid degradation and maximize coupling efficiency

    Final product types

    • Isoquinoline-derived agrochemical active intermediates
    • Pre-formulation herbicide concentrates

    3. Synthesis of Custom Fluorescent Markers in Analytical Reagents Sector

    In the specialty chemicals industry, analytical reagent manufacturers use Isoquinoline-5-Boronic Acid to engineer custom fluorescent probes for biological and chemical detection platforms. The boronic acid moiety participates in site-selective labeling via Suzuki coupling, enabling the synthesis of tailor-made fluorophores featuring unique emission wavelengths crucial for multiplex assays. Stringent quality oversight is essential throughout dosing, as residual impurities can undermine final signal fidelity.

    Industry compliance standards

    • ISO 13485:2016 for Diagnostic Reagent Production
    • RoHS Directive 2011/65/EU (where electronic detection integrations apply)
    • REACH Compliant Raw Material Management
    • DIN EN ISO/IEC 17025 Laboratory Accreditation

    Typical usage ratio

    • 0.8–1.1 molar equivalents based on functional group density of target scaffold; adjusted for photostability benchmarking

    Downstream process integration

    • Added during the scaffold assembly phase, immediately after the installation of electron-withdrawing groups to optimize fluorescence properties

    Final product types

    • Fluorescent dyes for bioanalytical assays
    • Chemical tracers for high-sensitivity diagnostics

    4. Manufacture of High-Performance Liquid Crystal Materials

    Producers of high-end liquid crystal display (LCD) materials incorporate Isoquinoline-5-Boronic Acid to build rigid, conjugated heterocyclic frameworks, directly impacting optical anisotropy and thermal stability of the resultant liquid crystal mixtures. The compound is typically introduced during precision-controlled coupling stages, determining final product purity and phase transition parameters in display-grade applications.

    Industry compliance standards

    • ISO 9001:2015 Certified Production Environment
    • UL 94 Flammability Rating Compliance (final LC mixture)
    • RoHS Directive for electronic and optoelectronic materials
    • JIS C 61000-4-2 (Japanese EMC Standard for displays)

    Typical usage ratio

    • 1.05–1.2 molar equivalents relative to halogenated biphenyl or phenylpyridine systems, dosage optimized for phase behavior and yield

    Downstream process integration

    • Reacted in the formation of mesogenic core units via Pd-mediated coupling, preceding the final blending with chiral dopants and purification

    Final product types

    • High-responsiveness nematic and smectic liquid crystals
    • LCD alignment materials supplied to display panel manufacturers
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    Certification & Compliance
    More Introduction

    Isoquinoline-5-Boronic Acid: A Closer Look from the Manufacturer's Bench

    Crafting Isoquinoline-5-Boronic Acid for Practical Laboratory and Industrial Application

    Every batch of Isoquinoline-5-boronic acid we release reflects years of know-how honed through hands-on work in the lab and feedback from our partners in research and industry. This compound, with the CAS number 98448-06-3 and the molecular formula C9H8BNO2, is more than just a reagent—it’s a building block with a growing reputation in heterocycle modification, drug development, and advanced material research.

    Why Chemists Favor Isoquinoline-5-Boronic Acid

    Traditional isoquinolines and their derivatives have shaped a wide range of syntheses. Isoquinoline-5-boronic acid sets itself apart through its boronic acid functionality, which opens up Suzuki-Miyaura cross-coupling chemistry—a direct route to aryl-aryl bond formation. Whether tackling a small library synthesis or upscaling for pre-clinical supply, chemists want predictability in yield and purity. Our production puts the focus on robust, reproducible results so customers reduce surprises at the bench.

    In real-world drug discovery projects, the 5-position offers a sweet spot for substitution without hindering the isoquinoline framework’s key interactions. Some colleagues in agrochemical discovery value this same flexibility, telling us that having pure, reliably supplied isoquinoline-5-boronic acid means less time second-guessing side reactions and more time making molecules. Supporting their projects through supply disruptions and specification tweaks makes all the difference, especially as research teams often face tight deadlines.

    From Scale-Up Synthesis to End-User Handling: What Matters Most

    Bringing this compound from a reaction flask to a stable, distributable product took more than just following published procedures. Isoquinoline-5-boronic acids can be finicky—handling moisture levels demands both disciplined plant engineering and well-trained staff. Early on, we encountered issues with clumping and lower recoveries because boronic acids are prone to forming hydrate species. In response, we re-engineered our drying protocols and switched packaging to moisture-grade containers that preserve shelf stability and guarantee users get a product that measures up on the analytical instruments.

    Each production campaign involves thorough checks using NMR, LC-MS, and HPLC. High-purity standards (usually above 98%) aren’t just a checkbox—they make a real difference in early-stage medicinal chemistry, where even tiny impurities can cloud SAR conclusions. We’ve also invested in training for our analytical team, because reading an HPLC chromatogram means little if you don’t know what “tails” or “ghost peaks” might signal. That hands-on approach—instead of relying on automation alone—gives us the confidence that our customers won’t run into surprises mid-route.

    The Edge Over Other Isoquinoline Derivatives and Boronic Acids

    Lab heads often ask how isoquinoline-5-boronic acid compares to its close cousins, such as isoquinoline-6-boronic acid or other heterocycle-based boronic acids. The answer boils down to three points: substitution pattern, electronic effects, and synthetic flexibility. Some alternative isomers shift electronics differently on the aromatic ring, which can reroute reactivity in cross-coupling. The 5-position delivers a compromise between steric accessibility and functional group tolerance, often translating to higher yields when other isomers give sluggish reactions or fail outright.

    Contrast this with classic phenylboronic acid or pyridine-based boronic acids: they lack the isoquinoline core, which for many medchem groups is the key pharmacophore. Swapping core structures mid-project could mean re-qualifying entire sets of compounds, so sticking with a pure isoquinoline-5-boronic acid makes sense for both timeline and budget. Over the years, we’ve tracked synthetic successes and failures from bench partners worldwide; those who start with consistently pure isoquinoline-5-boronic acid see fewer reruns of challenging couplings.

    From a manufacturing angle, selectivity in ring substitution keeps impurities under control. Other boronic acids we’ve produced—especially more heavily substituted or halogenated analogs—often bring extra steps to strip out regioisomeric byproducts. The process for isoquinoline-5-boronic acid, by contrast, sits in a proven window where we can push for scale without opening the door to a zoo of side products.

    Applications in Life Sciences and Beyond

    Medicinal chemistry remains the backbone for demand, with isoquinoline-5-boronic acid taking a seat as a precursor in kinase inhibitor scaffolds, GPCR ligands, and candidates in oncology drug discovery. Recent literature highlights several examples where direct aryl-aryl coupling at the 5-position gave clean access to new pharmacophores with improved selectivity profiles.

    Projects in advanced materials have picked up as well. Colleagues in electronic ink development and organic LED research use this compound to introduce functionalized isoquinolines into extended conjugated systems, aiming for tailored optoelectronic properties. For these teams, batch-to-batch consistency helps pin down structure-property relationships without running correction cycles for mismatched reaction outcomes.

    Research teams in agrochemical development find isoquinoline-5-boronic acid compelling for making novel herbicidal and fungicidal candidates, leveraging the versatility of the Suzuki coupling method. Our records include customer feedback on how boronic acid loading and quality impact downstream hydrogenation steps or functional group modifications. For these end-users, supply disruptions cause headaches of their own—so we keep production volumes aligned with forecasted growth in seasonal demand peaks.

    Real-World Manufacturing Experience: Learning from Challenges

    Manufacturing isoquinoline-5-boronic acid at scale doesn’t fit the image of a turn-key process. The literature would have you believe it’s a matter of “add boronic ester, react, and isolate,” but plant realities shape things differently.

    Setting up for scale-up, pressure points appear at solvent choice, reagent control, and isolation. We’ve learned through direct experience how water-sensitive boronic acids don’t forgive fast temperature swings or poorly dried starting materials. Missing those details introduces “sticky” product, color changes, and off-spec purity. Solvent selection became a trickier puzzle: while DCM or THF might work on paper, we spend time testing solvent lots for residual moisture and compatibility with our reactor linings. There’s a temptation to cut these corners for cost, but years of investigating failed campaigns always point to the same conclusion—cutting corners ends up costing more.

    Waste treatment marks another focus point that isn’t glamorous but can’t be ignored. Boronic acid residues and spent filter media call for specialized disposal routines. Our site invested early in on-site treatment units, trained the operations crew on handling protocols, and linked up with certified hazardous waste contractors. The financial numbers aren’t small, but the environmental and regulatory risks of improper disposal surpass any one-off savings.

    Worker safety rounds out the day-to-day reality. Boronic acids generally lack acute toxicity, but dust and solvent exposure add up in high-throughput environments. We prioritize protective barriers at all high-dust transfer points and audit PPE compliance weekly. It may sound routine, but over time the absence of exposure incidents proves its worth. Week after week, operators at our plant report healthy work conditions, which translates downstream into people taking pride in their role.

    Sourcing, Traceability, and Market Needs

    Reliable supply chains for isoquinoline-5-boronic acid call for more than chasing the cheapest upstream reagents. Our supply team cross-checks synthetic route flexibility, raw material purity, and vendor traceability before bringing a new kilogram into inventory. That approach paid off during broader chemical shortages, as we kept steady supply and shielded our customers from sudden outages.

    Pricing gets a lot of attention. While competitors sometimes race to the bottom, our experience tells us support and traceability win loyalty. One incident several years back sticks out—an atypical impurity showed up in several unrelated customer samples. Our records traced it back to a contaminated batch of starting isoquinoline. Transparent reporting, fast replacement, and clear corrective action meant not only did we keep that customer’s trust, but we also learned how to build more robust incoming inspection controls.

    Those steps matter for companies where regulatory demands in pharma or crop science keep inching higher each year. We maintain full batch records far beyond what’s required by most customers, including spectral archives and raw material origins. This “DNA trail” ensures we can backtrack any customer question or regulatory audit quickly and with data—not just assurances. Decision-makers tell us this transparent approach makes life smoother both upstream and in their own QA audits.

    Anticipated Future Directions in Synthesis and Product Design

    Research doesn’t stand still, and neither does demand for tailored building blocks. The next wave of requests points toward new isoquinoline-boronic acid derivatives, especially with additional halogen or alkyl substitutions for specific drug candidate programs. Talking with discovery scientists and process chemists, it’s clear that modifications on the boronate ester motif also hold promise for improving coupling chemistries.

    In our development lab, we’re experimenting with stabilizing certain boronate esters as alternatives for moisture-sensitive applications. These new formats could offer longer shelf life and simplified handling in open-bench scenarios. Pursuing these improvements means staying ahead of the curve—and embracing the feedback loop that comes from working closely with our collaborators, not just selling to them. Custom quote requests drive much of this innovation, with teams asking for new scales, alternate counter-ions, or package sizes adapted to both pilot and kilo-scale synthesis.

    We engage with academic research partners developing greener, lower-waste coupling methodologies. They’re eager to see how new protocols interact with our isoquinoline-5-boronic acid, especially in water-tolerant catalytic systems or mechanochemical applications. Joint trials have opened up data sharing and method optimization for both sides. This engagement with users at the front lines of R&D shapes our improvements—for example, minimizing residual inorganic impurities or offering detailed reactivity profiles for diverse catalytic systems.

    Quality Assurance: Beyond the Certificate of Analysis

    It’s one thing to provide a certificate of analysis with checkboxes for purity and identity; it’s another to ensure that the product in the bottle performs consistently across batches and over time. Our QC cycle integrates random-sample stress testing under working lab conditions—open air, variable humidity, and bench-top storage—so we know how the compound holds up even outside ideal storage.

    Complaints, though rare, get top attention. Each flagged case results in a root-cause investigation, leveraging our full digital batch and process tracking. One memorable instance involved a subtle shift in TLC mobility due to trace base contamination. Once identified, a tweak to wash protocols fixed the issue, and updated analytical alerts flagged any recurrence. These field-level insights, gathered from real users, support continuous updating of our standard protocols.

    For high-stakes projects—preclinical API, import registration, or regulatory dossier—partners often request extra documentation, impurity profiles, or additional stability data. We maintain a reserve sample library for retrospective testing, so our partners have a safety net as projects progress. This secondary layer reduces risk for critical projects where repeat syntheses or documentation gaps can cost months.

    Environmental and Regulatory Commitments

    Managing the environmental footprint of boronic acid production means more than meeting minimum legal requirements. We operate closed-loop waste handling for most aqueous streams, with continual monitoring for boron and aromatic residuals. Outreach programs with local environmental authorities aim to minimize cumulative impact, using both in-house and third-party validation of our measurement techniques.

    Compliance with international transport and handling norms protects both our partners and our team. Since many of our shipments cross borders for pharmaceutical and crop science research, full labeling for GHS and trace documentation accompanies each shipment. Colleagues tackling new regulatory requirements for substances in the European Union or North America count on us for timely, accurate paperwork and updates on evolving rules.

    Workplace safety standards hold equal weight. Every production shift starts with safety briefings, and ongoing skills upgrades help new staff learn best practices. By sharing key safety learnings with downstream users—especially newer teams—we aim to reduce risk across the entire synthetic value chain, not just within our own gates.

    The Value of Direct Manufacturer Partnership

    Working with a chemical manufacturer, rather than a distributor or broker, brings tangible benefits for R&D teams and production chemists alike. Our team’s investment in full transparency, supply continuity, and technical backup helps customers focus on pushing chemistry forward. Over the years, direct conversations with research groups have driven real improvements—be it adjusting purity thresholds for challenging syntheses, switching package sizes to reduce waste, or troubleshooting unexpected bench problems.

    We believe a manufacturer’s job goes beyond providing a bottle of product. Our willingness to learn from user feedback, run targeted re-analyses, or share insights from our broader network means customers benefit from the collective experience of many development cycles. The growing community of chemists sharing their own successes and challenges with isoquinoline-5-boronic acid forms a feedback loop that pays off for everyone involved.

    Conclusion: Building Success Beyond the Molecule

    We continue to refine our offering of isoquinoline-5-boronic acid based on the realities of scale, the demands of research, and the input of industry veterans. Our plant runs on more than just reactors and pumps; it runs on years of expertise, openness to feedback, and respect for the practicalities that chemists face every day. By keeping lines open and standards high, we help our partners unlock the potential of this versatile boronic acid—today and for the next wave of innovation.