|
HS Code |
973163 |
| Name | 2-Trifluoromethyl-4(1H)-pyrimidinone |
| Molecular Formula | C5H3F3N2O |
| Molecular Weight | 164.09 g/mol |
| Cas Number | 2251-59-2 |
| Appearance | White to off-white solid |
| Melting Point | 133-136 °C |
| Solubility | Soluble in organic solvents such as DMSO and methanol |
| Pka | Approx. 9.2 (for the NH group) |
| Smiles | C1=CN=C(NC1=O)C(F)(F)F |
| Inchi | InChI=1S/C5H3F3N2O/c6-5(7,8)3-1-9-4(11)10-2-3/h1-2H,(H,10,11) |
| Storage Conditions | Store at room temperature in a tightly closed container |
| Synonyms | 2-(Trifluoromethyl)pyrimidin-4(1H)-one |
As an accredited 2-Trifluoromethyl-4(1H)-pyrimidinone factory, we enforce strict quality protocols—every batch undergoes rigorous testing to ensure consistent efficacy and safety standards.
| Packing | The 10g quantity of 2-Trifluoromethyl-4(1H)-pyrimidinone is securely packaged in a sealed amber glass bottle with tamper-evident cap. |
| Container Loading (20′ FCL) | Container Loading (20′ FCL) for 2-Trifluoromethyl-4(1H)-pyrimidinone ensures secure, efficient bulk chemical transport, maximizing space and minimizing contamination. |
| Shipping | 2-Trifluoromethyl-4(1H)-pyrimidinone is typically shipped in tightly sealed containers to prevent moisture absorption and degradation. It should be transported under cool, dry conditions and protected from direct sunlight. Appropriate hazard labeling is applied, and packaging follows regulations for chemical substances to ensure safety during transit and handling. |
| Storage | 2-Trifluoromethyl-4(1H)-pyrimidinone should be stored in a tightly sealed container, in a cool, dry, and well-ventilated area, away from direct sunlight and sources of ignition. Keep it away from incompatible substances such as strong oxidizers. Ensure the storage area is clearly labeled and restrict access to authorized personnel familiar with handling hazardous chemicals. |
| Shelf Life | **Shelf Life**: 2-Trifluoromethyl-4(1H)-pyrimidinone is stable for at least 2 years when properly stored, tightly sealed, and protected from moisture. |
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At the core of our production line, 2-Trifluoromethyl-4(1H)-pyrimidinone has long earned its place as a benchmark for consistent, high-purity pyrimidinone derivatives. Manufacturers of agrochemicals and pharmaceuticals look for precision and reliability in these niche intermediates. After years handling nuanced processes like nucleophilic substitutions and functional group transformations, it’s clear that the industry demands more than just “product on demand”: seamless integration, reproducibility, and performance set apart a strong supplier from a weak link.
Our 2-Trifluoromethyl-4(1H)-pyrimidinone comes primarily in white crystalline form, with a purity aimed above 98%, supporting scalable synthesis for both pilot and large-batch needs. Chemists gravitate toward this structure because the trifluoromethyl group introduced at the 2-position unlocks unique electronic and steric profiles within the pyrimidine ring. This subtle but meaningful alteration impacts reactivity—modulating hydrogen-bonding, solubility, and metabolic stability—something that, in our experience, researchers capitalize on across discovery and process optimization alike.
Over the years, we have refined our synthetic approach to minimize side products and ensure uniform particle characteristics. Strong control over crystallization conditions deters formation of polymorphs common to heterocyclic chemistry. This attention to detail pays off: feedback from development teams points toward faster purification and less variable downstream kinetics in their own hands. Many routes that depend on cleaner, more predictable pyrimidinones now depend on this high degree of batch reproducibility.
Substituting a trifluoromethyl group at the 2-position infuses significant character into the pyrimidinone scaffold. Unlike conventional methyl or halogen substitutions, the strong electron-withdrawing effect of the CF3 group alters electron density across the ring, boosting chemical robustness and tempering nucleophilicity at key reactive positions. Matched against other pyrimidinones, this version typically resists hydrolysis and preserves core integrity through challenging arylation or alkylation steps. When integrating such a substitution into lead series or crop protection templates, the performance increase can be pronounced—not just in stability, but in final biological activity profiles.
In the pharmaceutical sector, these features open the door for building blocks capable of controlled pharmaceutical release, or for those whose metabolites need to show low toxicity and defined clearance. Agrochemical developers turn to 2-Trifluoromethyl-4(1H)-pyrimidinone for advanced fungicide, herbicide, or growth regulator research programs, with demonstrated benefits in enhancing target specificity. The kind of SAR profiling enabled by this intermediate would be hard to match with more pedestrian C-2 substituents.
Working side by side with chemists tackling exploratory synthesis or process scale-ups, we often field questions about the difference between this molecule and its unsubstituted or mono-methyl analogs. Experience shows that reactivity trends can diverge sharply even between small pyrimidinone modifications. Stepwise transformation to a target often hinges on trifluoromethylation at a strategic intermediate stage. Other substituents tend to complicate purification, drop yields in critical condensations, or produce off-flavors in biological screens. Returning to the reliability of this fluorinated version saves both time and resources at every level.
Production of 2-Trifluoromethyl-4(1H)-pyrimidinone requires far more than a simple condensation or cyclization. Real market presence grew from our investment in facility upgrades and process analytics designed explicitly for pyrimidine derivatives. We rely on modern reactors fitted with temperature, pressure, and real-time impurity monitoring. This offers a level of control that cuts down on laborious rework and downstream waste. Chemical manufacturing is rarely forgiving of shortcut methods: shortcuts show up in customer analytics, often at the worst possible time. So every run is tracked by high-performance liquid chromatography, mass spectrometry, and spectral analysis—nothing hits the shipping dock without this detail.
The result is a product with no surprises—at least, not the kinds that trigger costly troubleshooting on a client’s end. From controlled precursor sourcing to minimized solvent residue, the routine details aggregate into tangible customer benefits. For instance, reproducible particle sizing means less variability in dissolution studies, and tighter impurity profiles keep regulatory headaches at bay during later stage development. Standard lot sizes range from a few hundred grams for pilot projects up to multiple metric tons. Our scale flexibility supports early-stage synthesis as well as established commercial formulations that have strict quality audit trails.
Nearly every phone call or email from a development chemist asks about batch-to-batch consistency. No one wants their process to perform perfectly one week, then drift off course with a new lot number. Our batch records trace every production step, and our clients routinely send back testimonials on reduced downtime. Reproducibility in pyrimidine chemistry anchors customer reputations downstream—something both sides can’t afford to risk.
Walking through the lab benches, you’ll often see 2-Trifluoromethyl-4(1H)-pyrimidinone stacked alongside kinase inhibitor scaffolds, or being portioned for early SAR screens in crop protection candidates. Years ago, researchers relied heavily on basic pyrimidinones, only to find themselves stuck with limited modulation over their final compound’s properties. The arrival of this CF3 variant unlocked new levers of control. Screening compound libraries became more fruitful, and selectivity ratios in biological assays improved measurably. Recent patent filings highlight its rise in core synthesis strategies for critical APIs and advanced crop protection leads.
Researchers confirm the advantage in metabolic stability conferred by the CF3 moiety. Enzymatic breakdown studies consistently turn up longer half-life metrics and lower rates of unwanted side chain cleavage when this group sits on the ring. In early absorption and pharmacokinetics trials, formulations retain activity through pH transitions that used to degrade standard pyrimidinones. Agrochemical researchers appreciate the robust field persistence—trifluoromethyl groups seldom succumb to oxidation or hydrolysis under challenging agricultural conditions. These nuanced chemical features enable new products, not just incrementally different versions of yesterday’s technology.
Handling characteristics stem directly from how a manufacturer treats crystallization, filtration, and drying procedures. Inferior process control leads to variable solubility. Feedback from downstream formulating chemists often draws attention to dusting, clumping, or caking in competitive materials. We resolved these issues through process tweaks, tightening our granulation and milling steps for a well-defined particle profile. The outcome—better wettability and more predictable solubilization in both aqueous and organic solvents.
Our facilities use climate-controlled rooms for storage, extending shelf life without the need for bulky desiccant packages or aggressive packaging. Pyrimidinones fare best under dry, ambient conditions, with less risk of unwanted hydrolysis or oxidation when storage rooms are tightly maintained. That’s how we keep re-order customers choosing us over time—fewer headaches from unstable or out-of-spec lots.
Comparing product lines, major differences emerge when you evaluate 2-Trifluoromethyl-4(1H)-pyrimidinone against plain 4(1H)-pyrimidinone or even its chloro/fluoro analogs. Most obvious is the electron-withdrawing punch of the trifluoromethyl group—a feature that lets downstream synthetic steps run under milder conditions or deliver higher purity. In practical terms: methylated or halogenated pyrimidinones tend to produce more byproducts in Suzuki and Heck couplings, which burdens users with cleanup and lower final yields.
Choosing this specific intermediate changes workflow on the ground. In pharmaceutical chiral synthesis, product color and impurity trends reflect starting material control above all. We hear from QA colleagues at formulation sites who notice a visible difference: less yellowing, less tendency to absorb atmospheric moisture. With certain analogs, storage stability causes more returns due to product degradation. Our feedback loop with end-users—pharma, crop science, and specialty chemical clients—proves that tighter product control upstream means smoother running downstream. Staying one step ahead on reactivity saves months in development time and cuts waste.
Today’s industry monitors regulatory shifts far more closely than a decade ago. Chemical suppliers must document origin, impurity profiles, and environmental impact. Our team stays plugged in with the latest RoHS and REACH initiatives to handle concerns around fluorinated intermediates. It’s not just paper compliance—even a single solvent change in production can ripple outward, altering raw material sourcing or hazardous waste protocols.
Sourcing trifluoromethyl-containing precursors challenges many manufacturers: few vendors sustain regular, high-purity supply, and even fewer track their GHG emissions or wastewater loads. Our team audits upstream providers for environmental benchmarks and pushes for greener synthesis routes wherever feasible. These actions pay off: clients developing new agrochemical formulations face mounting pressure from regulatory agencies, especially as more eyes track PFAS-related compounds. In response, we configured our own purification suites to minimize solvent emissions and run in closed-loop water systems—fewer headaches for everyone during downstream audits.
Analytical transparency makes a difference. We welcome client audits, provide open access to impurity profiles, and support regulatory dossier compilation. Clients tell us these practices shave months off their regulatory review cycles. The 2-Trifluoromethyl-4(1H)-pyrimidinone we supply holds a clean analytical record, demonstrated through both internal and third-party testing. Downstream approval paths rarely get smoother by chance; sustained, open data-sharing moves the entire industry forward.
Chemists may start with milligram samples, but commercial synthesis needs hundreds of kilograms run after run. Delivering a consistent, high-purity pyrimidinone batch means understanding the human side of the supply chain. Raw material logistics, on-the-ground troubleshooting, and continuous dialogue with both lab staff and plant engineers—none of this can be automated without sacrificing quality. We assign project managers who track every stage from order intake to lot release, catching blips or trends before they compound into quality issues.
It’s not uncommon for our customers to request tailored particle sizes or experimental runs using alternate crystallization solvents. This close communication avoids downstream surprises and empowers teams to shave development timelines. Our technical support team works directly with clients adjusting to process scale-up, troubleshooting any challenges unique to pyrimidinone chemistry. Custom runs, flexible lot sizes, and responsive scheduling keep new projects on course, even as requirements evolve midstream.
Stock keeping and lead times reflect more than spreadsheets and forecasts. Facility engineers know the pain of delayed shipments when a plant runs short of key intermediates. We maintain safety stocks on frequently ordered pyrimidinones and flag any impending delays instantly. Track record matters: during global shipping disruptions, our advanced planning meant zero missed customer launches last fiscal year, even as many peers struggled.
Having been an active participant in chemical manufacturing for years, we watched the transition from artisanal labs to highly automated, data-rich facilities. Old techniques for pyrimidinone production simply cannot satisfy modern compliance or throughput needs. Regular internal reviews, benchmarking against industry standards, and hands-on operator training all reinforce our competitive edge. We draw directly from on-the-ground manufacturing experiences—upgrades to filtration or pH control happen after real problem-solving, not from guessing or following the crowd.
As pyrimidinone usage diversifies, so too has our collaboration with outside innovators. Shared process improvements ripple through the supply chain, enabling end users to diversify their synthetic portfolios without fear of intermediate supply risk. Lessons learned from pilot plant missteps or commercial batch hiccups funnel into quality system enhancements, with each challenge feeding better product reliability. The pursuit of ever-higher purity, eco-friendly processing, and rapid response to evolving customer needs—these are guiding priorities, not just slogans.
As science advances, demands for specialized intermediates like 2-Trifluoromethyl-4(1H)-pyrimidinone will outpace generic options. Pharmaceutical pipelines move closer to highly customized molecules, and crop protection faces increased scrutiny for environmental safety. These realities drive us to innovate at every step, from precursor sourcing to packing finished product for worldwide delivery. Our dedication to detail, open feedback channels, and long-term technical support ensures that both emerging companies and established giants have a manufacturing partner they can rely on—every batch, every shipment.
By putting firsthand experience and technical care at the heart of 2-Trifluoromethyl-4(1H)-pyrimidinone production, we help research leaders and industrial specialists push chemical boundaries safely and efficiently. The journey from precursor to commercial lot isn’t always sleek, but with strong manufacturing practices and constant process self-improvement, we deliver the reliability and performance needed to turn new chemical ideas into practical, life-changing solutions.