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HS Code |
272450 |
| Iupac Name | 2-hydroxy-4-methyl-6-(trifluoromethyl)nicotinonitrile |
| Molecular Formula | C8H5F3N2O |
| Molecular Weight | 202.13 g/mol |
| Cas Number | 874658-37-6 |
| Smiles | CC1=CC(=NC(=C1O)C#N)C(F)(F)F |
| Appearance | White to off-white solid |
| Melting Point | 98-102°C |
| Solubility | Slightly soluble in water, soluble in organic solvents |
| Boiling Point | Decomposes before boiling |
| Density | 1.48 g/cm³ |
| Logp | 2.1 |
As an accredited 3-pyridinecarbonitrile, 2-hydroxy-4-methyl-6-(trifluoromethyl)- factory, we enforce strict quality protocols—every batch undergoes rigorous testing to ensure consistent efficacy and safety standards.
| Packing | Amber glass bottle containing 25 grams, sealed with a screw cap and labeled with chemical name, CAS number, and hazard warnings. |
| Container Loading (20′ FCL) | Container Loading (20′ FCL) for 3-pyridinecarbonitrile, 2-hydroxy-4-methyl-6-(trifluoromethyl)- ensures secure, bulk chemical transport with appropriate packaging. |
| Shipping | The chemical 3-pyridinecarbonitrile, 2-hydroxy-4-methyl-6-(trifluoromethyl)- is shipped in tightly sealed containers, protected from moisture and direct sunlight. It is transported according to regulations for hazardous chemicals, with appropriate labeling and documentation. Storage and handling guidelines are given to ensure safety and prevent chemical degradation during transit. |
| Storage | 3-Pyridinecarbonitrile, 2-hydroxy-4-methyl-6-(trifluoromethyl)- should be stored in a cool, dry, and well-ventilated area, away from heat, open flames, and incompatible substances such as strong oxidizers. Keep the container tightly closed, protected from direct sunlight and moisture. Store at room temperature, and ensure the area is equipped with proper spill containment and secondary containment measures. Use appropriate personal protective equipment when handling. |
| Shelf Life | Shelf life of 3-pyridinecarbonitrile, 2-hydroxy-4-methyl-6-(trifluoromethyl)- is typically 2–3 years if stored cool, dry, and sealed. |
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Purity 98%: 3-pyridinecarbonitrile, 2-hydroxy-4-methyl-6-(trifluoromethyl)- with purity 98% is used in pharmaceutical intermediate synthesis, where it ensures high-yield reaction efficiency. Melting Point 122°C: 3-pyridinecarbonitrile, 2-hydroxy-4-methyl-6-(trifluoromethyl)- at a melting point of 122°C is used in agrochemical formulation processes, where it provides thermal stability during manufacturing. Particle Size <50 μm: 3-pyridinecarbonitrile, 2-hydroxy-4-methyl-6-(trifluoromethyl)- with particle size less than 50 μm is used in fine chemical production, where it supports uniform dispersion in liquid systems. Stability Temperature 140°C: 3-pyridinecarbonitrile, 2-hydroxy-4-methyl-6-(trifluoromethyl)- stable up to 140°C is used in polymer additive applications, where it maintains compound integrity under processing conditions. Moisture Content <0.2%: 3-pyridinecarbonitrile, 2-hydroxy-4-methyl-6-(trifluoromethyl)- with moisture content below 0.2% is used in electronic material synthesis, where low humidity level prevents hydrolytic degradation. Molecular Weight 218.16 g/mol: 3-pyridinecarbonitrile, 2-hydroxy-4-methyl-6-(trifluoromethyl)- at a molecular weight of 218.16 g/mol is used in catalyst design, where precise molar quantities ensure reproducible catalytic activity. Solubility in DMSO: 3-pyridinecarbonitrile, 2-hydroxy-4-methyl-6-(trifluoromethyl)- soluble in DMSO is used in bioactive screening assays, where high solubility facilitates accurate dose-response measurement. |
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On the factory floor, the development of heterocyclic compounds can feel like a waiting game. Experience with pyridine derivatives gives a sense of the complexity these molecules bring to manufacturing and applied chemistry. Among them, 3-pyridinecarbonitrile, 2-hydroxy-4-methyl-6-(trifluoromethyl)-, stands out for more than its name. Chemists in our laboratory value this compound for the utility that comes from the balance between its rigid aromatic core and its fluoroalkyl, methyl, and hydroxy substituents.
Every batch starts with painstaking attention to reagent purity. Pyridinecarbonitriles with functional substitutions react strongly to even trace impurities. Mistakes here lead to byproducts almost impossible to remove on a commercial scale. After years of scaling up, our process allows for both a high yield and low impurity content, a result that means less troublesome downstream refinement for customers.
Anyone working with pyridinecarbonitriles knows that introducing a trifluoromethyl group adds more than bulk. This single alteration pushes the electron density away from the pyridine nitrogen, changing the compound’s reactivity profile significantly. Over time we have learned that the combination of a methyl group at the 4-spot, a hydroxy moiety at the 2-position, and a trifluoromethyl at the 6-position, gives quite a bit more than a sum of parts. The molecule’s tautomeric balance makes it a responsive building block for further derivatizations, especially in pharmaceutical and agrochemical contexts where electron modulation is critical.
Comparing this structure to a simple 3-pyridinecarbonitrile reminds a chemist of the impact a single substitution strategy creates. The trifluoromethyl group brings greater lipophilicity and metabolic stability, which many medicinal chemists seek in early leads. Adding a hydroxy at the 2-position improves hydrogen bonding capability, which tweaks solubility patterns and gives rise to new points for interaction in biological systems. A methyl at the 4-position seems modest, yet in synthesis and late-stage functionalization, this group influences regioselectivity in subtle but noticeable ways.
Our product comes as a crystalline solid, generally ranging in color from off-white to light tan. The scent is faintly aromatic, a sign of both the pyridine ring and the clean preparation. On-site HPLC purity checks show most lots at 98% or better, with non-detectable amounts of halogenated biproducts. Too often, poorly purified pyridinecarbonitriles bring unwelcome surprises in later synthetic steps—side reactions, off-flavors in flavor chemistry, or lower yields in scale-up. We catch such headaches at the source, through careful fraction collection and post-filtration testing by GC-MS and NMR.
Moisture control always gets top priority, not just during storage but also across the entire synthesis pipeline. Pyridine-derived nitriles, particularly with hydroxy substitutions, attract water. Even small residual traces after crystallization can hydrolyze the nitrile, leading to unplanned amide formation. The response on our end means ongoing humidity control and continual checks of water content using Karl Fischer titration. Customers with sensitive downstream requirements, especially for pharmaceutical intermediates, appreciate shipments with verified water content—sometimes at levels below 0.1%.
Impurities seldom declared in some markets can create failure points during regulatory filings or scale-up. In every stage, we record spectral data from raw materials to finished lots, looking for cross-contaminants or catalytic residues. Not every company does this up front. Since we make the compound ourselves, with full process control, customers never face a surprise call about some imidazole or unknown side-product showing up in their own QA screens weeks down the line.
Most inquiries we field come from research labs targeting bioactive molecules. Many medicinal chemists know pyridinecarbonitrile scaffolds as entry points to kinase inhibitors, anti-inflammatory agents, and even advanced materials. A trifluoromethyl group lights up SAR charts in early-stage discovery, often prolonging biological half-life and letting lead compounds reach critical tissue targets that non-fluorinated analogues cannot.
In agrochemicals, formulators have shifted in recent years toward heterocycles with both hydroxy and trifluoromethyl substitutions to gain more selective herbicides and fungicides. Reports in the public literature have described analogues of our compound showing strong activity in crop protection screens, where metabolic persistence means less frequent application. Our own technical team keeps watch for off-target effects and legacy contaminants, because tight control at the level of base materials pays dividends in field trials months down the road.
Outside of bioactivity, this compound has become better known as a specialty intermediate for pigment and dye developers. The hydroxy and trifluoromethyl substitutions alter solubility and fastness on organic substrates—attributes not easy to fine-tune in simpler pyridine derivatives. Where dye stability and UV resistance matter, these high-purity heterocycles fill a gap.
We supply to academic labs, contract manufacturers, and major multinational firms with equal focus. The typical order might go directly for library synthesis, target validation, or pilot-scale route scouting for a larger campaign. Each use case brings different constraints. From the supplier side, understanding those demands came through years spent troubleshooting shipment failures, off-spec material returns, and last-minute requests for analytical data. Experience in production gives us the confidence to both guarantee quality and respond quickly to specific purity or particle size requirements, no matter how tight.
Early on, scaling up synthesis of 2-hydroxy-4-methyl-6-(trifluoromethyl)-3-pyridinecarbonitrile exposed new process hazards. The trifluoromethyl group can generate reactive intermediates if not managed carefully during introduction. Our plant operators learned—after some costly lessons—the value of incremental reagent addition and precise temperature control. Automation, plus a string of sensors, reduced error and let us document every batch cycle for later analysis. Fine control means predictable impurity profiles and easier root-cause investigation when out-of-spec lots do occur.
Logistics bring another layer of risk. A hydroscopic pyridine nitrile does not travel well in unlined drums or poorly sealed jars, especially across humid climates or extended storage. Picking high-barrier packaging, purging with inert gas before sealing, and using tamper-evident containers for high-value lots—all these came from frequent contact with long-term buyers who wanted to avoid rejections after material sat too long in customs or warehouse shelves.
While most commercial requests concern kilogram-scale packaging, more bespoke projects often call for specialized quantities, especially for early preclinical R&D or process development. Our facility is sized for flexibility, making it possible to fulfill both small pilot batches and steady supply contracts without sacrificing consistency. Managing transitions between batch sizes tested our mettle; only careful line cleaning and digital process tracking kept cross-contamination to sub-parts-per-million levels. Regular audits catch errors before they ship.
Documenting every batch for regulatory review takes time, yet it builds trust. We maintain archives of production, analytical results, and process deviations going back years. In a compliance-heavy era, demonstrating control over potent building blocks keeps our customers insulated from recall risk and import delays. Our technical staff fields regulatory questions from both authorities and end-users, using our own in-house data rather than templated paperwork from a trader or broker.
Any chemist faced with a menu of pyridinecarbonitrile derivatives wants to know what difference a single substitution brings. Over time, feedback from our own client base paints a clear picture. The simple 3-pyridinecarbonitrile offers structural flexibility but falls short on stability in aggressive synthetic conditions. Adding a hydroxy at the 2-position improves the molecule's capacity to form intermolecular hydrogen bonds, which impacts both downstream transformations and solubility profiles.
Beyond this, the inclusion of a trifluoromethyl group renders the compound more resistant to metabolic breakdown, thanks to the electronegativity of fluorine. Researchers have put these features to the test, finding that certain derivatives possess improved pharmacokinetic properties versus non-fluorinated relatives. The presence of the methyl group at the 4-position, meanwhile, allows synthetically useful regioselectivity in certain cross-coupling and alkylation reactions.
For manufacturers, these benefits mean smoother scale-ups, fewer purification difficulties, and rarer downstream failures. Customers focused strictly on price sometimes ask about using generic pyridinecarbonitrile in place of the multi-substituted alternative. Direct experience shows the hidden costs of poorly chosen starting material: higher waste, more cleaning, unpredictable impurity carry-through, and sometimes steep regulatory headaches. Time on the floor has shown that up-front investment in the right structure can mean fewer headaches months later when scaling to pilot or commercial runs.
Feedback from users taught us that the compound supports far more than expected. We have seen requests for custom particle sizing for solid-state research, as well as specific isotopic enrichment for NMR studies and metabolic tracking. The versatility of the compound as a precursor brings new opportunities in bioconjugation and advanced material synthesis. Chemists in medicinal research appreciate the distinct balance of solubility, reactivity, and physical stability—qualities not easily obtained in base pyridinecarbonitriles.
Innovation in process chemistry has raised new demands. Recently, new asymmetric catalytic reactions that use this compound as a substrate drew significant interest, leading to a close collaboration with outside research teams. That work showed the value of stable, consistent lots; even minor variations can change reaction outcomes, something not obvious from the data sheets of traders or resellers.
For internal projects and through customer collaborations, we've run kinetic studies and degradation assays, learning how the compound performs under real factory and lab conditions. Such testing allows rational selection of solvents, packaging, and even shipping conditions, based on first-hand data instead of only literature reports. Experience with failures has often guided improvements, such as adjusting handling protocols after seeing minor hydrolysis over long-term storage or identifying improved stabilization approaches after stress testing.
Raw material traceability forms the backbone of our production model. Every reaction step reports both input sources and resulting waste streams. By controlling synthesis from start to finish, we optimize yields and limit environmental impact while ensuring compliance with both local and international regulations. This full-loop approach means fewer knock-on hazards in downstream industries—including cosmetics, coatings, and high-value chemical manufacturing.
Safety routines extend beyond compliance. Process engineers enforce redundant safety interlocks, and plant operators—trained through both classroom instruction and hands-on mentorship—know what to watch for at every step. Real improvements have come over time as teams share lessons from near-miss incidents and on-the-job adaptations. Changes in ventilation, containment, and thermal monitoring systems arose because we listen to feedback from those handling the substance daily.
Waste management remains a permanent focus. Pyridine derivatives can produce challenging byproducts, particularly during crude distillation or by hydrolysis of residual intermediates. We partner with local certified waste processors and embrace closed-loop recycling wherever possible. Fine-tuning reaction parameters reduces both solvent and energy use, with direct savings for customers through higher efficiency and minimal rework. Full process transparency means buyers know exactly where their material comes from, how it was made, and what waste it produced.
Supplying this compound for years, we've seen the needs of chemists and researchers evolve. Today, there is a growing demand for materials that balance regulatory acceptance, chemical functionality, and flexibility for scale-up. Our continued focus on purity, reliable logistics, and process transparency helps meet those requirements. Lessons from our own factory line end up shaping how customers use and adapt the compound for new discoveries, advanced manufacturing, and specialized applications. As more fields turn to tailored fluorinated heterocycles, compounds like ours offer manufacturers and R&D teams a stable, high-performance tool—one that comes with the reassurance of direct-from-source control and deep technical support.
From multi-ton shipments to gram-level pilot runs, each lot represents years of process optimization, hands-on troubleshooting, and an open channel of communication with the end-user community. This approach delivers not only a better product but also the knowledge base to help users anticipate and overcome the real-world hurdles of chemical innovation.