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1-Methyl-3-Trifluoromethyl-2-Pyrazolin-5-One

    • Product Name 1-Methyl-3-Trifluoromethyl-2-Pyrazolin-5-One
    • Alias Metribuzin
    • Einecs 629-145-3
    • 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
    VTB
    Specifications

    HS Code

    975577

    Chemical Name 1-Methyl-3-Trifluoromethyl-2-Pyrazolin-5-One
    Molecular Formula C6H5F3N2O
    Molecular Weight 178.11 g/mol
    Cas Number 2554-40-3
    Appearance White to off-white crystalline powder
    Melting Point 117-120°C
    Solubility In Water Slightly soluble
    Smiles CN1C(=O)C=CN(C1)C(F)(F)F
    Purity Typically ≥98%
    Storage Conditions Store in a cool, dry place
    Synonyms Edaravone trifluoromethyl derivative

    As an accredited 1-Methyl-3-Trifluoromethyl-2-Pyrazolin-5-One factory, we enforce strict quality protocols—every batch undergoes rigorous testing to ensure consistent efficacy and safety standards.

    Packing & Storage
    Packing The 1-Methyl-3-Trifluoromethyl-2-Pyrazolin-5-One is packaged in a sealed 25g amber glass bottle with safety labeling.
    Shipping 1-Methyl-3-Trifluoromethyl-2-Pyrazolin-5-One is shipped in tightly sealed containers, protected from moisture and light. It should be transported according to local and international regulations for chemicals, ensuring proper labeling and documentation. Handle with care, using appropriate personal protective equipment during shipping and handling to avoid exposure or spillage.
    Storage 1-Methyl-3-trifluoromethyl-2-pyrazolin-5-one should be stored in a tightly closed container, in a cool, dry, and well-ventilated area, away from direct sunlight and incompatible materials such as strong oxidizers. Avoid humidity and high temperatures. Proper chemical labeling and secondary containment are recommended to prevent leaks or accidental exposure. Follow all relevant safety and handling guidelines for laboratory chemicals.
    Application of 1-Methyl-3-Trifluoromethyl-2-Pyrazolin-5-One

    Applications of 1-Methyl-3-Trifluoromethyl-2-Pyrazolin-5-One in Industrial Manufacturing

    1-Methyl-3-Trifluoromethyl-2-Pyrazolin-5-One serves as a specialized building block in key chemical industries, supporting advanced synthesis for high-value end-products. As a direct manufacturer, we supply this intermediate to certified downstream partners requiring consistent quality, tight impurity control, and full compliance with global standards.

    1. Pharmaceutical Intermediates for Antipyretic Drugs

    Our raw material supports synthesis of specific pyrazolone-based APIs, particularly in antipyretic and analgesic formulations. Pharmacopeia-monitored processes use it in the critical condensation steps, ensuring consistency in purity profiles demanded by regulated markets. Downstream use includes multi-step reactions under cGMP production, monitored by validated in-process controls and batch release testing.

    Industry compliance standards

    • ICH Q7 Good Manufacturing Practice for Active Pharmaceutical Ingredients (APIs)
    • USP/NF and European Pharmacopoeia API monographs where applicable
    • 21 CFR Part 210/211 for finished dose manufacture
    • Pharmaceutical Inspection Co-operation Scheme (PIC/S) GMP Guide

    Typical usage ratio

    • Reactant load: 0.20–0.35 molar equivalents relative to main substrate
    • May vary 10% up or down based on targeted yield and impurity control
    • Subject to in-house process validation and customer-specific route

    Downstream process integration

    • Introduced during the initial heterocycle formation or amidation stage
    • Integrated in dedicated reaction vessels with validated solvent loads
    • Inline filtered and traced through HPLC for purity compliance before downstream conversion

    Final product types

    • Bulk antipyretic and analgesic pharmaceutical actives
    • Granulated intermediates for tablet, capsule, or injectable formulations
    • Blended powders supplied to formulation units under Drug Master File (DMF) registration

    2. Crop Protection Synthesis: Herbicide Intermediate

    This compound enters the pesticide sector as a key ring-structure donor in the synthesis of fluorinated herbicides. Agrochemical facilities use it in specific coupling and cyclization protocols, meeting ISO and OECD standards for environmental and process safety. The manufacturing window requires carefully managed dosing and reaction times to ensure correct isomer configuration and application efficacy in the finished herbicide concentrate.

    Industry compliance standards

    • ISO 9001:2015 certified quality systems for agrochemical intermediates
    • OECD Good Laboratory Practice for environmental safety testing
    • REACH (EC) No 1907/2006 compliance for raw material handling in Europe
    • China National GB/T 22298 pesticide manufacturing standards

    Typical usage ratio

    • Standard addition level: 8–15% by weight of total coupling reaction feed
    • Adjustable based on target molecule and batch scale
    • Custom protocols for high conversion in large-scale continuous processes

    Downstream process integration

    • Added in the controlled cyclization stage of herbicide synthesis
    • Introduced via automated liquid feed to batch or semi-batch reactors
    • Strictly monitored for trace byproducts using mass spectrometry QC

    Final product types

    • Active herbicide technical concentrate
    • Emulsifiable concentrate formulations for field use
    • Pre-mix granules for agricultural application

    3. Specialty Dye Manufacturing for Industrial Textiles

    Downstream dye manufacturers incorporate this pyrazolinone derivative in the design of high-durability, fluorinated azo dyes. It functions as a key diazo component, providing thermal stability and resistance against photobleaching in performance textile coloring. The component enters the coupling reaction sequence, and strict wastewater handling applies according to both industrial dye standards and local regulations.

    Industry compliance standards

    • OEKO-TEX® Standard 100 for restricted substances in textile dyes
    • ZDHC MRSL (Manufacturing Restricted Substances List) guidance
    • ISO 105-C06 wash fastness test procedures
    • Local Environmental Protection Agency (EPA) effluent codes

    Typical usage ratio

    • 0.5–2.0% by total dye batch mass, based on shade intensity targets
    • Ratio set via lab batch trials to meet coloring and fastness specs
    • Smaller additions in labile fiber blends to manage compatibility

    Downstream process integration

    • Coupling stage after diazotization in dye synthesis reactor trains
    • Transferred to high-shear stir tanks with color developer agents
    • Washing and purification follow to achieve regulated residue levels

    Final product types

    • Industrial textile dyes for polyester, nylon, or blended synthetic fabrics
    • Color fast coating solutions
    • Pigments for automotive and technical fabrics

    4. Fine Chemical Synthesis: Fluorinated Heterocycle Production

    This compound serves as a specialized scaffold in the custom synthesis of advanced fluorinated heterocycles for laboratory and electronic applications. Custom fine chemical producers, including those supplying materials for OLEDs and specialty reagents, use it to build target molecules under high-integrity batch documentation and traceable raw material sourcing. The process demands precise stoichiometric feed and real-time monitoring to prevent off-target isomerization.

    Industry compliance standards

    • ISO 9001-certified laboratory manufacturing controls
    • Specialty Chemicals Market Association quality adherence
    • Responsible Care® Global Charter for chemical stewardship
    • Internal material tracking protocols per customer NDA requirements

    Typical usage ratio

    • 1.0:1.0 stoichiometric ratio, adjustable to 1.2:1 for target fluorination
    • Refined via analytical yield tracking for high-value downstream use
    • Process chemist guidance based on electronic grade specification

    Downstream process integration

    • Primary scaffold formation in the first synthesis stage
    • Direct addition with nitrogen purge to prevent oxidative degradation
    • Followed by multi-step conversion to target functionalized heterocycles

    Final product types

    • Fluorinated building blocks for electronics and OLED device R&D
    • Custom research reagents for analytical laboratories
    • Advanced intermediates for specialty performance polymers
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    Certification & Compliance
    More Introduction

    Introducing 1-Methyl-3-Trifluoromethyl-2-Pyrazolin-5-One: A Chemist’s Perspective

    Understanding Our Product

    Experience in chemical synthesis shapes the way we look at specialty intermediates. Working with 1-Methyl-3-Trifluoromethyl-2-Pyrazolin-5-One (also known as MTFP) is no exception. Over years in production, our team has learned that the small differences in molecular structure make a world of difference in downstream applications.

    The appeal of this compound stems from its unique structure—a fusion of a methyl group at position 1 and a trifluoromethyl group at position 3 on the pyrazolone ring. That configuration results in marked changes in electronic properties and reactivity patterns compared to the simpler pyrazolinones or those with alternative substitutions.

    Model and Specifications: Going Beyond Basic Purity

    In the past decade, requests from both pharmaceutical and agrochemical sectors have pushed us toward achieving tighter controls on impurity profiles and trace contaminants. Our MTFP model targets a purity exceeding 98% by HPLC, but the focus goes much further than just that number. We use NMR, GC-MS, and LC-MS to confirm the minimal presence of mutagenic impurities or residual solvents. Customers need reliable melting point repeatability and spectral consistency, particularly for structural elucidation and downstream processing, so every lot undergoes rigorous quality verification, often exceeding regional pharmacopoeia recommendations.

    Packet sizes range from gram-scale R&D lots to multi-kilo commercial orders. We tackle solubility challenges by offering the solid crystalline form, compacted with carefully controlled moisture content to avoid caking and stability loss, important for companies with long supply chains or storage cycles.

    Why Structural Distinctions Matter in Application

    Chemistry is a detail-driven enterprise. The addition of the trifluoromethyl group sets this compound apart from other 1-methyl or plain 2-pyrazolin-5-ones. The electron-withdrawing effect of the CF3 group alters the lability of the hydrogen at position 4, directly affecting tautomeric equilibrium. Colleagues in medicinal chemistry appreciate how this makes MTFP both a valuable scaffold and a reactive handle for further modification.

    Compared to non-fluorinated pyrazolones, our material resists oxidative degradation for longer times and retains integrity even under demanding reaction conditions. Customers working on building blocks for active pharmaceutical ingredients (API) rely on these stability advantages, reducing losses and minimizing process interruptions.

    Applications Shaped by Lab Insights

    Real-world synthesis has taught us the practical value of 1-Methyl-3-Trifluoromethyl-2-Pyrazolin-5-One. Medicinal chemists use it as a precursor for the synthesis of a range of biologically active molecules, leveraging the pyrazolone ring’s known pharmacophoric properties. Scientists constructing COX-inhibitor analogues prefer our compound for its predictable reactivity and reduced byproduct formation. The electron-deficient nature of the trifluoromethylated ring supports selective alkylation and acylation under conditions that might degrade standard pyrazolones.

    Beyond its role in small-molecule drug discovery, some agrochemical innovators employ MTFP as a core in novel pesticidal candidates. The trifluoromethyl group confers both lipophilicity and metabolic stability—traits vital for animal health and environmental persistence studies. Each kilogram we ship often participates in projects investigating new fungicides, herbicides, or veterinary actives.

    Working with academic collaborators, we've observed use in coordination chemistry, where the ligand ability of pyrazolinones provides unique pathways to metal complexes. The steric and electronic effects of the trifluoromethyl and methyl groups influence binding modes, giving rise to new catalytic or sensor materials.

    Challenges and How We Respond

    Producing MTFP at scale comes with some difficulties. The synthesis relies on controlling conditions to ensure regioselective formation of the desired trifluoromethylated pattern—side reactions can introduce positional isomers or over-substituted molecules. Because our customers work in regulated industries like pharma and crop protection, even minor amounts of these side products can compromise downstream application.

    Years in the pilot plant have shown us that not every supplier pays attention to the detailed analysis required to weed out these troublesome byproducts. We learned the hard way through failed scale-ups and rejected lots: one cannot cut corners in purification if one wants repeat business from discerning process chemists or formulations teams.

    Sometimes demand outpaces available supply of clean trifluoromethylation reagents. We respond by securing relationships with producers of the core fluorine-containing intermediates, allowing us to buffer against market instability. Staff monitor global shifts in raw material cost, so we can maintain predictable pricing for our customers even when shortages strike elsewhere.

    Comparison With Other Related Molecules

    We often field questions from users debating whether to purchase our MTFP instead of other pyrazolones or methylated analogues. The key lies in the impact on chemical behavior. In contrast to 1-methyl-2-pyrazolin-5-one, the CF3 group's strong electron-withdrawing property lowers the pKa of adjacent protons and alters the UV absorption profile. These tweaks carry through to both analytical and synthetic stages—HPLC detection and chromatographic separations become easier, while selectivity in reactions such as Knoevenagel condensations improves.

    Customers switching from non-fluorinated analogues typically report reduced batch-to-batch variability in downstream transformations, especially where oxidative or hydrolytic stability is critical. The additional methyl group at the 1-position reduces ambiguity in NMR peak assignment, a minor but important practical consideration during structure confirmation.

    In formulations, the trifluoromethyl group improves compatibility with both hydrophilic and lipophilic systems, allowing formulators to broaden the palette of ingredients without extensive reoptimization. That enables a smoother translation from bench to pilot plant for those developing APIs or active crop protection agents, compared to starting with unsubstituted materials.

    Safety and Handling from an Operator’s Viewpoint

    Many intermediates can pose risks if mishandled—years on the production line have taught us to respect the volatility of hazardous reagents, even with materials considered “low-toxicity” on paper. While MTFP falls within standard safety classifications for solid organics, emphasis remains on fine particulate containment and dust suppression. Operators use local exhaust ventilation and personal protective equipment, based on lessons learned from minor exposure incidents in our earlier days.

    Labeling and transport align with domestic chemical safety standards, and customers requiring special packouts—such as double bagging or inert atmosphere packaging—can rely on our documented protocols. While we have not observed acute toxicity issues at the scale produced, we advocate for lab-scale users to consult the full safety dossier before moving to pilot or industrial scale.

    Why Manufacturing Location Matters

    Modern chemical manufacturing takes place in a world of shifting supply chains and evolving regulatory oversight. Our own facility is strategically located close to major chemical feedstock producers, providing steady inflow of the basic methylating and fluorinating agents required for MTFP synthesis. That proximity reduces shipment delays and permits faster adjustment to customer schedule changes.

    We invest in continuous process control to minimize waste generation and energy consumption—essential now as sustainability goals become industry standard. Waste streams are monitored for traces of organofluorine residues and are treated on-site to avoid downstream environmental impact.

    Regular engagement with local regulatory agencies keeps our operations ahead of unexpected changes in waste handling guidelines or hazardous substance declarations. The experience gained through regular audits bleeds over into our documentation and electronic batch tracking, which customers working in regulated sectors have found useful during inspections or supply chain qualification exercises.

    Addressing Customer Demands With Flexibility

    Customers sometimes need project-specific modifications—altered particle sizes, alternative solvents for slurry delivery, or custom stability studies. Success in this area depends not on rigid process adherence, but on day-to-day flexibility and lab-scale responsiveness. Our technical staff maintain open communication with R&D teams from a wide swath of companies, both multinational and early-stage startups.

    We recently partnered on a scale-up project geared toward new veterinary actives. A tight timeline motivated us to develop a parallel filtration and drying approach. Collaboration with the client’s analytical chemists led to an inline process monitoring method, minimizing the risk of mislabeling and improving real-time batch release. These small process tweaks, informed by hands-on experience rather than top-down policy, are what keep our product valued by repeat users.

    Where customers request compliance around nitrosamine impurities, our batch analysis suite includes routine scans for these and other genotoxic contaminants. By routinely sharing COA results and providing complete transparency in impurity profiles, we support partners through their own regulatory submissions and reduce delays caused by ambiguity or incomplete documentation.

    Current Trends and Where We Go Next

    Increasing digitization in lab operations pushes us toward more granular batch traceability and instant sharing of analytical results. Customers want not only a clean product but also fast turnarounds on technical questions or support for method development. Our expanded analytical database allows quick retrieval of impurity trends and stability data for past lots, which aids both our troubleshooting and our partners’ quality assurance teams.

    The growth in green chemistry principles has challenged us to re-examine not just how the product is made, but also downstream life cycle questions like bioaccumulation from possible environmental release of fluorinated organics. One area of active R&D for us is alternative fluorination strategies, aiming to reduce the generation of perfluorinated byproducts without compromising the yield or performance of MTFP.

    With new guidelines emerging across regions—including the EU’s ongoing scrutiny of organofluorine chemicals and the corresponding updates in Asian and American markets—we monitor and anticipate regulatory movement. Engaging in early dialogue with stakeholders, regulators, and academic specialists anchors our development of next-generation processes and documentation requirements for both established and novel uses of pyrazolinone derivatives.

    Reflections on Industry Collaboration

    Ultrapure specialty chemicals emerge not in isolation, but from a continuous interplay between producers, researchers, and end-users. Our experience with MTFP production underscores the returns of long-term, honest conversation. Sharing both setbacks and best practices with our customers leads to formulations and synthetic discoveries not possible in a closed, transactional environment.

    Regular site visits and lab exchanges with external collaborators have brought to light new process improvements and identified previously unknown application windows—in one case, revealing enhanced performance of a related series of agrochemical intermediates, thanks to a subtle tweak in the trifluoromethylation sequence.

    A transparent feedback culture ensures refinements in our drying and milling process, improving the handling and performance characteristics batch over batch. The growth of regulatory harmonization presents challenges but also delivers clarity, allowing us to design product quality protocols meeting or exceeding the highest international standards from the outset.

    Conclusion: Why 1-Methyl-3-Trifluoromethyl-2-Pyrazolin-5-One Endures

    The compound's distinctive molecular structure fuels innovation across pharmaceutical, agrochemical, and advanced material markets. Years of manufacturing, troubleshooting, and application support reinforce the simple lesson that reliable sourcing and tight process control create true value for our end users. From the early days of small-batch, labor-intensive synthesis to current multi-kilo campaigns, the most meaningful advances have always come from a commitment to practical detail over theoretical promises.

    Looking ahead, our focus remains on more sustainable production, with even tighter impurity control and expanded technical support. 1-Methyl-3-Trifluoromethyl-2-Pyrazolin-5-One looks set to remain a mainstay for chemists seeking robust, high-performance building blocks. We see its role continuing to grow, not just through traditional uses but new discoveries still waiting on the lab bench.