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3-(Trifluoromethyl)Phenylboronic Acid

    • Product Name 3-(Trifluoromethyl)Phenylboronic Acid
    • Alias TFMPBA
    • Einecs 257-249-6
    • 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
    • CONTACT NOW
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    Specifications

    HS Code

    778013

    Product Name 3-(Trifluoromethyl)Phenylboronic Acid
    Cas Number 5122-89-6
    Molecular Formula C7H6BF3O2
    Molecular Weight 189.93 g/mol
    Appearance White to off-white powder
    Purity Typically ≥97%
    Melting Point 145-149°C
    Solubility Soluble in DMSO, methanol; slightly soluble in water
    Density 1.41 g/cm³
    Smiles B(C1=CC(=CC=C1)C(F)(F)F)(O)O

    As an accredited 3-(Trifluoromethyl)Phenylboronic Acid factory, we enforce strict quality protocols—every batch undergoes rigorous testing to ensure consistent efficacy and safety standards.

    Packing & Storage
    Packing 3-(Trifluoromethyl)Phenylboronic Acid, 5g: Supplied in a sealed amber glass bottle with tamper-evident cap and printed hazard labeling.
    Shipping 3-(Trifluoromethyl)Phenylboronic Acid is shipped in tightly sealed containers, typically under inert gas or desiccant to prevent moisture exposure. It is packaged according to safety regulations for chemicals, often housed in sturdy, impact-resistant bottles placed in padded boxes. Shipment complies with local and international hazardous material transport guidelines.
    Storage 3-(Trifluoromethyl)Phenylboronic Acid should be stored in a tightly sealed container, in a cool, dry, and well-ventilated area, away from light, moisture, and incompatible substances such as strong oxidizers. Avoid exposure to air to prevent degradation. Recommended storage temperature is 2–8°C (refrigerator). Handle under inert atmosphere if possible to maintain purity and prevent hydrolysis.
    Application of 3-(Trifluoromethyl)Phenylboronic Acid

    Applications of 3-(Trifluoromethyl)Phenylboronic Acid in Industrial Manufacturing

    3-(Trifluoromethyl)Phenylboronic Acid serves as a critical intermediate in the synthesis of advanced materials, pharmaceutical compounds, and high-performance electronic chemicals. The following sections detail main downstream application scenarios where use of this raw material aligns with specific industry requirements, formulations, and regulatory frameworks.

    1. Pharmaceutical API Development: Suzuki–Miyaura Coupling Reactions

    Major pharmaceutical manufacturers apply this boronic acid in active pharmaceutical ingredient (API) synthesis, especially for the construction of biaryl motifs through Suzuki–Miyaura cross-coupling. The electron-withdrawing trifluoromethyl group enhances selectivity and increases metabolic stability for certain target APIs such as kinase inhibitors and CNS-active drugs. This intermediate enters early-stage synthesis and quality assurance controls strictly monitor residual boron content in the final API batch.

    Industry compliance standards

    • ICH Q7 Good Manufacturing Practice Guidance
    • US Pharmacopeia (USP) regulations for chemical purity
    • EMA and FDA impurity profiling guidelines
    • REACH—Substance Information Requirements for pharmaceutical intermediates

    Typical usage ratio

    • 0.9–1.2 equivalents to aryl halide substrates; optimized based on catalyst loading and scale
    • Adjusted to minimize by-products and ensure high API yield

    Downstream process integration

    • Charged into reaction vessels with palladium catalyst and aryl halide at the cross-coupling stage
    • Subsequent purification follows to remove residual boronic acid and metallic impurities
    • Continuously monitored in process analytical technology (PAT) systems during scale-up

    Final product types

    • Small-molecule kinase inhibitors
    • Selective serotonin receptor antagonists
    • Anticancer drug intermediates containing trifluoromethyl-substituted aryls
    • Early-stage drug development leads in CNS and metabolic disorders

    2. Organic Electronic Materials: OLED and Display Component Synthesis

    This boronic acid compound enters the synthesis routes of high-performance materials for organic electronics, notably for OLED emitters, electrophosphorescent hosts, and advanced display chemicals. The CF3 functional group introduces desirable electronic characteristics, including improved electron mobility and thermal stability within aromatic frameworks. Manufacturers must control trace contaminants to meet electronic-grade purity benchmarks throughout the handling and incorporation process.

    Industry compliance standards

    • RoHS Directive—Restriction of Hazardous Substances for electronic components
    • ISO 9001:2015 certified quality management for materials
    • JIS C 61000—Electronic material standards
    • ITO and OLED device-grade purity specifications

    Typical usage ratio

    • 5–12 mol% relative to monomer feedstock; adapts to end-device emission layer design
    • Adjusted depending on film-forming performance and charge transport experiment data

    Downstream process integration

    • Introduced in the organic synthesis phase of emitter or host molecules via cross-coupling reaction
    • Purified intermediates subjected to melt or solution processing for device fabrication
    • Final blending on OLED panel production lines

    Final product types

    • OLED emitters with enhanced color purity
    • Electroluminescent host materials
    • Touch panel coatings with enhanced electron affinities
    • Thin film transistor (TFT) organic components

    3. Agrochemical Active Ingredient Synthesis: Trifluoromethylated Aryl Agents

    Producers of crop protection and agrochemical formulations utilize this boronic acid for building blocks in herbicide and fungicide actives, especially where trifluoromethyl aryl groups improve biological activity and field performance. The reactive boronic group allows for precise coupling with halogenated intermediates under catalytic conditions, resulting in robust agrochemical molecules suitable for volume manufacturing.

    Industry compliance standards

    • FAO/WHO Codex Alimentarius for pesticide technical materials
    • OECD principles of GLP (Good Laboratory Practice)
    • EPA 40 CFR Part 180—Tolerance for pesticide chemicals in food
    • Chinese GB 2763—Maximum residue limits

    Typical usage ratio

    • 1.0–1.3 equivalents per target aryl halide in scaffold assembly steps
    • Adjusted on lab-to-plant scale transition to limit unreacted material and optimize yield

    Downstream process integration

    • Introduced at the stage of aryl ring construction via Suzuki cross-coupling under inert atmosphere
    • Pilot and production batches purified to meet residual solvent and heavy metal limits
    • Final actives sent to formulation units for emulsifier or microcapsule dispersion blending

    Final product types

    • Trifluoromethyl-substituted fungicides
    • Pre- and post-emergence herbicides
    • Agrochemical spraying solutions with longer residual activity
    • Seed treatment actives utilizing stable aryl frameworks

    4. Fine Chemicals and Specialty Polymers: Performance Additive Precursors

    Within the specialty chemical sector, downstream users incorporate this compound as a functionalized aromatic precursor during the manufacture of high-performance polymers and coatings. It brings chemical resistance and thermal stability through integration into polyarylene or polythiophene backbones, crucial for demanding environments such as industrial coatings, specialty adhesives, and engineering polymer blends. Raw material controls and formulation adjustments are standard to align with customer product specifications.

    Industry compliance standards

    • ISO 14001—Environmental management for chemical manufacturing
    • REACH (EC) No 1907/2006 reporting for specialty chemicals
    • UL 94 flame retardancy requirements (where relevant)
    • ASTM D638 polymer mechanical property test standards

    Typical usage ratio

    • Varies from 1.5–6 wt% in the functionalization step, tailored per polymer matrix and property targets
    • Formulators fine-tune loading based on downstream compatibility and thermal analysis results

    Downstream process integration

    • Fed to oligomer or polymerization stages after pre-mixing with comonomers and initiators
    • Blends are extruded, cast, or cured based on end-use application
    • Product undergoes third-party QC testing for structure confirmation and residual monomer content

    Final product types

    • Chemically resistant engineering plastics
    • Specialty anti-corrosive coatings for electronics and pipes
    • Advanced adhesive resins
    • Performance film additives for packaging and transport

    5. Analytical Reagent Synthesis: Derivatization Agents for Chromatography

    Manufacturers of analytical reagents utilize this boronic acid in the synthesis of derivatization agents and calibration standards for use in high-performance liquid chromatography (HPLC) and gas chromatography (GC) techniques. The trifluoromethyl group’s strong electron-withdrawing character improves analyte detection sensitivity, enabling precise quantification of trace organics in environmental, pharmaceutical, and food safety testing. Stringent batch documentation and purity assurance are maintained for this segment.

    Industry compliance standards

    • ISO/IEC 17025 laboratory reagent certification
    • USP general chapters for chromatographic reagents
    • Analytical reference material requirements—LGC, Sigma-Aldrich
    • GLP documentation for reagent traceability

    Typical usage ratio

    • 0.05–0.2 mmol per sample in reagent preparation for derivatization protocols
    • Adjusted according to target analyte concentration and method sensitivity requirements

    Downstream process integration

    • Introduced during synthesis of lab-developed derivatization agents in batch or semi-batch mode
    • Formed agents purified and standardized by NMR and HPLC analysis
    • Final reagents bottled and lot-verified for use in analytical laboratories

    Final product types

    • HPLC and GC derivatization agents
    • Chromatographic calibration standards
    • Trace organic residue testing chemicals
    • Environmental and food safety analytical kits
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    Certification & Compliance
    More Introduction

    3-(Trifluoromethyl)Phenylboronic Acid: Our Experience as Its Manufacturer

    What Makes 3-(Trifluoromethyl)Phenylboronic Acid Stand Out

    On our production floor, 3-(Trifluoromethyl)Phenylboronic Acid (often called TFMPBA or simply 3-TFMBA) draws attention every time someone requests it. Each batch moves through synthesis with a clarity that shows the experience behind it. Chemists know this compound for the unusual balance between its molecular structure and practical application in modern research and industry, but what sets it apart comes through most clearly at the point of manufacture.

    The backbone of 3-TFMBA—an aromatic ring paired with a robust trifluoromethyl group at the meta position—gives this compound more than just chemical curiosity. That -CF3 pattern doesn’t just alter reactivity; it reliably boosts stability and sometimes even points the reaction in new directions compared to its non-fluorinated boronic acid cousins.

    Our Standard: Model and Specification Choices

    Most of the samples we ship carry a purity above 98%. Regular HPLC and NMR verification anchors quality well beyond typical spot checks. Years ago, we found that only full-spectrum analysis gives real peace of mind for research, and clients share that view. Production aligns to support gram-scale research all the way up to multi-kilo orders—solid batches with steady, off-white to pale yellow crystalline texture. Water content rarely rises above 0.5%, as even modest moisture shifts can disrupt downstream Suzuki couplings or other reactions.

    Melting points for our 3-TFMBA lots hover around 132°C to 136°C—a tight range we hit batch after batch. We routinely measure the exact value, knowing that anything off might hint at residue or decomposition. Storage in tightly sealed containers under nitrogen atmosphere avoids unwanted oxidation or hydration. We use high-grade solvents and handle purification steps with controlled temperatures, since trifluoromethylated aromatics sometimes pose purification challenges that less experienced players might underestimate.

    Handling and Practical Reality: Lessons from the Lab

    Colleagues in R&D appreciate how 3-TFMBA slides neatly into cross-coupling schemes, especially for Suzuki-Miyaura couplings. That boronic acid moiety offers a direct entry point for attaching a trifluoromethyl-phenyl motif to various halides—an advantage over non-fluorinated boronic acids or those with electron-donating substitutions. The trifluoromethyl group tends to introduce lipophilicity, metabolic stability, and a significant electronic effect, traits sought after in agrochemicals and pharmaceuticals.

    We produce both small and large lots, and each request tells its own story. A kilo-scale customer in crop protection chemistry might ask for extra documentation on trace metal contamination. University researchers working with only a few grams often want certificates of analysis, chromatograms, and freshly packed material with confirmed shelf life. Over several years, we have found clear and constant communication prevents issues—from bottle labeling confusion, to requesting alternate solvents for dissolution.

    Handling 3-TFMBA demands care. With direct skin contact, irritation sometimes occurs, and dust control remains non-negotiable in each transfer or weighing step. Our team learned early that open scooping or agitated transfers simply causes loss and contamination risk. Automated dispensing lines inside well-ventilated enclosures have since become the default. When scaling up, minor impurities—such as mono- and di-fluoro by-products—tend to appear unless purification steps get real attention. The more vigilant the QC, the cleaner the final profiles.

    Real Use Cases and Performance Feedback

    The most regular request comes from synthetic organic chemists looking to build complex scaffolds for pharmaceutical lead compounds or crop protection candidates. In our experience, 3-TFMBA tends to outperform traditional phenylboronic acids in certain C–C coupling scenarios, especially when electron-deficient aromatic systems are desired. Many chemists favor its stable crystalline form, which stores far better than some boronic acids that slump or oil at room temperature.

    Process managers on the client side send feedback often focused on batch-to-batch reproducibility, and there are few greater rewards than seeing a customer’s yields track upward after switching to our product. A medicinal chemistry team highlighted the improved solubility profile of their target analogs after employing the trifluoromethyl group, which originated from material we produced. Our team cross-referenced this observation with known literature, where the trifluoromethyl moiety’s role in drug metabolism becomes clear—providing greater resistance to oxidative degradation and increasing the lifetime of orally administered compounds.

    Material scientists and polymer researchers point out the influence of the trifluoromethyl group on physical properties. In some high-performance polymers and liquid crystal screens, the rigidity and electronegativity of -CF3 introduced via 3-TFMBA led to measurable changes in dielectric behavior and thermal resistance. These were borne out in thermal gravimetric analysis—showing real, quantifiable differences against otherwise similar phenylboronic derivatives.

    What Sets Our Process Apart

    From the procurement of specialty trifluorotoluene feedstock to the selection of catalysts for borylation, our process relies on steady hands and proven routes. While automation quickens output, careful monitoring of temperature and pH throughout the reaction makes the decisive difference. Purity levels above 99% often require dual recrystallization and a cautious hand during vacuum drying, since premature heating promotes structural breakdown.

    On our site, batch tracking goes far beyond regulatory compliance. Every shipment carries a certificate with QR-coded analytics, tying the finished product to the original synthesis notes. Stability trials in glass ampoules, updated every six months, give us an honest look at long-term storage impact, particularly since atmospheric moisture and light slowly alter the boronic acid group’s reactivity.

    Packaging options have improved over time. Initially, we wrapped all boronic acids in basic double-poly bags with silica gel. Experience with fluorinated boronic acids taught us that molecular sieves, inner glass bottling, and mylar-lined outer packs provide far better protection, especially for long-term stock in regions with high relative humidity.

    The Differences: 3-TFMBA Compared to Standard Phenylboronic Acids

    Ask any of our senior chemists, and they will rattle off a handful of distinctions between 3-(Trifluoromethyl)Phenylboronic Acid and classic phenylboronic acid. Most notably, the trifluoromethyl group reduces nucleophilicity—altering both reactivity and selectivity during metal-mediated coupling. This allows for enhanced compatibility with halides that might otherwise stumble on traditional boronic acids, helping the synthetic organic community reach tougher targets without side reactions from over-active aromatic centers.

    Thermal stability counts as another hard-won asset. Experiments in our labs show 3-TFMBA resists decomposition those extra few degrees, translating to less degradation during high-temperature processing. For weight-critical or moisture-sensitive applications, the extra heft and stability provided by the -CF3 group can mean the difference between a successful pilot and wasted bench time.

    Researchers in medicinal fields often point to the increased lipophilicity and metabolic stability the trifluoromethyl group imparts. In contrast, basic phenylboronic acid offers neither the same degree of membrane permeability nor resistance to oxidative breakdown. These traits give 3-TFMBA a clear path into drug discovery pipelines, where a single functional-group swap can flip an entire SAR profile and improve pharmacokinetics.

    Quality Concerns and our Approach to Problem Areas

    Looking back, early runs of 3-TFMBA often showed modest contamination from unreacted trifluorotoluene or side-chain isomers. The biggest change came from refining our catalyst system and strictly controlling water content during boronation. Through routine submissions to independent QC firms, blind analysis reports soon flagged hidden trends in trace impurity carry-over. This chronic feedback loop shaped improvements in purification, ultimately bolstering client confidence over time.

    Trace metal contamination never stays hidden for long. We invested in ICP-MS instruments and set internal action limits below regulatory thresholds. Even low-level palladium or rhodium residues can ruin catalytic tests on the user side, so full trace metal scans accompany every kilo-scale batch.

    Bottle-to-bottle consistency challenged us at higher volumes. At 100-gram scale, crystallization quirks or slight atmospheric exposure can alter appearance. Fresh desiccant, inert-atmosphere repacking, and proactive communication with downstream handlers keep our partners from running into these avoidable pitfalls.

    Supporting Sustainable Production and Safe Use

    Fluorinated aromatics, by virtue of their stability, often linger in the environment longer than simpler organics. Our process design attempts to reduce the impact. All solvent is recovered and distilled—reducing both the cost and chemical waste. Scrubbers on our vent lines and well-maintained carbon filters protect air and water outflows, reflecting growing attention to environmental stewardship. Waste streams with traces of organofluorine are separated for safe handling and incineration.

    On the end-user side, we encourage safe handling practices. Recent years brought an uptick in requests for technical support addressing safe scale-up and disposal procedures, and we answer every question with direct feedback—from handling emergencies to tracing cause for unexpected results. Alongside each shipment, we include notices on proper ventilation, PPE, and simple spill response, based not on legal necessity but genuine experience from our own facility.

    Why 3-TFMBA Continues to Gain Ground

    As the field moves forward, new classes of therapeutics and crop-protection solutions increasingly depend on small but critical changes to molecular frameworks. The addition of a single trifluoromethyl group—especially in the meta position—often determines success or failure for a new molecule’s biological target and commercial potential. Our customers’ projects now routinely integrate 3-TFMBA, not just as a reagent but as a strategic building block tied to their intellectual property and market goals.

    Medicinal chemistry teams and process chemists regularly cite the product’s storability, crystalline handling, and robust coupling behavior as reasons for their repeat orders. Scale-up teams credit the compound’s resistance to pH and light-related decomposition with enabling longer reaction campaigns. For every gram made, shipped, and turned into value downstream, our small improvements in synthesis, purification, and packaging ripple outward into higher yields and faster research timelines.

    Troubleshooting and Lessons Learned

    No operation runs perfectly, and we’ve weathered our share of issues in manufacturing and distribution. On more than one occasion, a client isolated fines or laid down material differing slightly in hue from previous lots. Our approach avoids excuses. Open review of each production log, side-by-side analyses, and—when needed—a no-cost resupply always resolved confusion. Every issue redirected attention back to solvent system tweaks, better protection from light, and improved operator training.

    By listening carefully, we discovered the key practical issues: batch color variation, crystal clumping from atmospheric exposure, and the impact of minor impurities on catalytic runs. Each identified problem led to subtle improvements, and today, every operator on our line can outline the critical details that distinguish a good batch from a great one.

    Continuous Innovation: Responding to Industry Needs

    The landscape keeps shifting. As transition-metal catalysis and automated synthesis platforms become central to both academia and commercial process design, demand for 3-TFMBA continues to rise. Our production has risen in parallel—not by scaling every operation equally, but by segmenting lines dedicated to tight impurity control and responsive QC. Growing interest in new cross-coupling methodologies prompted us to revisit each manufacturing step routinely, seeking catalysts and purification approaches that push both throughput and cleanliness higher.

    Our in-house team regularly engages with customers not just as a product source, but as a partner in solving technical puzzles. When labs encounter reactivity issues or analytical anomalies, we drill into the chemistry jointly—sometimes following up with custom syntheses or alternate salt forms to improve solubility or fit new coupling schemes. These collaborations feed back into process improvements and ultimately benefit everyone relying on our product.

    Industry Trends and Our Forward Path

    What once counted as a specialty reagent now anchors dozens of new product development plans. In the last year alone, several long-term clients linked successful project milestones to effective use of 3-TFMBA sourced directly from our facility. We document and share these success stories internally and with partners, fully recognizing that our role extends beyond making the compound itself to enabling long-term innovation in medicinal, agricultural, and materials research.

    As regulation tightens and new analytical standards emerge, we respond with more agile internal controls and transparent supply chain communication. We view our product not in isolation, but as part of a global network of research, discovery, and molecular engineering. Every kg shipped carries a record not only of its chemical makeup, but of a set of values for quality, safety, and responsible production.

    Final Thoughts from the Manufacturer’s Perspective

    3-(Trifluoromethyl)Phenylboronic Acid stands today at a unique intersection of complexity and utility. Long gone are the days of uncertain syntheses, vague certificates, or tolerance for avoidable inconsistencies. As we look back on the collective lessons earned from years of scaling up, tightening QC, and repairing inevitable hiccups in production, our team feels a genuine sense of pride for each improvement. The compound’s reputation grows not from marketing, but from the results and feedback of those who use it to push boundaries and build better solutions in the real world.