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HS Code |
185564 |
| Chemical Name | 3,4,5-Trimethoxybenzonitrile |
| Cas Number | 1780-13-2 |
| Molecular Formula | C10H11NO3 |
| Molecular Weight | 193.20 |
| Appearance | White to off-white solid |
| Melting Point | 106-110°C |
| Boiling Point | 325°C (estimated) |
| Density | 1.21 g/cm3 (estimated) |
| Solubility In Water | Slightly soluble |
| Smiles | COC1=CC(=CC(=C1OC)C#N)OC |
| Inchi | InChI=1S/C10H11NO3/c1-12-8-4-7(6-11)5-9(13-2)10(8)14-3/h4-5H,1-3H3 |
| Refractive Index | 1.557 (estimated) |
| Flash Point | 148.2°C (estimated) |
| Storage Conditions | Store at room temperature, away from light and moisture |
| Pubchem Cid | 13925 |
As an accredited 3,4,5-Trimethoxybenzonitrile factory, we enforce strict quality protocols—every batch undergoes rigorous testing to ensure consistent efficacy and safety standards.
| Packing | A 25-gram amber glass bottle with a screw cap, clearly labeled "3,4,5-Trimethoxybenzonitrile" and hazard warnings. |
| Shipping | 3,4,5-Trimethoxybenzonitrile is shipped in tightly sealed containers, protected from moisture and light. It should be transported in compliance with relevant chemical safety regulations, typically as a non-hazardous substance. Ensure packaging prevents leaks or spills, and include appropriate labeling. Store in a cool, dry place during transit to maintain chemical integrity. |
| Storage | 3,4,5-Trimethoxybenzonitrile should be stored in a tightly sealed container in a cool, dry, and well-ventilated area, away from incompatible substances such as strong oxidizers and acids. Protect from moisture and direct sunlight. Store at room temperature and avoid heat sources. Properly label the container and keep it away from food and drink. Follow local regulations for chemical storage. |
Applications of 3,4,5-Trimethoxybenzonitrile in Industrial ManufacturingAs a direct producer of 3,4,5-Trimethoxybenzonitrile, we support a portfolio of specialized chemical and pharmaceutical manufacturers globally with reliable bulk supply. The following application notes outline established industrial uses of this intermediate, with clear boundaries on compliance benchmarks, formulation guidance, manufacturing integration, and downstream product types. All scenarios are grounded in real-world commercial manufacturing. 1. Pharmaceutical Intermediate for Antihypertensive APIsPharmaceutical companies use this material primarily as a key intermediate in the synthesis of some antihypertensive active pharmaceutical ingredients (APIs), such as certain calcium channel blockers. The aromatic ring's electron distribution, provided by the methoxy groups, supports regioselective functionalization in later stages of drug synthesis. The material enters the synthetic sequence generally in the nitrile-to-amide conversion or aromatic coupling steps, where its purity and particle size distribution directly influence final API yield and impurity profile. Industry compliance standards
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2. Fine Chemical Intermediate in Agrochemical SynthesisAgrochemical manufacturers employ this intermediate in multi-step syntheses of certain fungicides and herbicides. Its electron-rich aromatic moiety introduces crucial selectivity in downstream functionalization reactions, ensuring consistency in the conversion to bioactive aromatic ether compounds. Chemists depend on narrow impurity profiles to maintain regulatory acceptance for agricultural products. Industry compliance standards
Typical usage ratio
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3. Building Block in High-Performance Dye ManufacturingProducers of organic dyes for industrial coatings and plastics incorporate this aromatic nitrile into advanced chromophore synthesis, particularly when synthesizing trimethoxy-based dye scaffolds. The material's methoxy pattern stabilizes chromophoric systems and enhances solubility properties for downstream formulation, supporting high color strength and lightfastness required in automotive and textile applications. Industry compliance standards
Typical usage ratio
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4. Precursor Component in Specialty Organic Electronic MaterialsAdvanced material manufacturers add this compound during the synthesis of certain organic semiconductors and liquid crystal intermediates. Its methoxy functionalization provides targeted tuning of electron affinity and enhances the material’s compatibility with downstream polymer matrices, which is critical in developing custom optoelectronic properties for display and sensor devices. Formulation scientists rely on consistent purity and moisture content to avoid process variability in high-value batch production. Industry compliance standards
Typical usage ratio
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5. Key Intermediate in Flavors and Fragrances Ingredient SynthesisManufacturers in the flavors and fragrances sector utilize this material as a rigid intermediate in the multi-step synthesis of certain specialty aroma compounds, especially where the ortho-para substitution pattern is essential. The methoxy group arrangement influences both olfactory profile and volatility, with tight control needed over the nitrile's conversion during hydrogenation and oxidative steps to prevent undesirable by-products impacting sensory analysis. Industry compliance standards
Typical usage ratio
Downstream process integration
Final product types
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Every industry relies on certain core molecules. For us, 3,4,5-Trimethoxybenzonitrile has proven itself in countless projects, and we have seen its impact at every step of our synthesis lines. Many downstream chemistries, especially in pharmaceutical intermediate production and advanced material preparation, benefit from the reactivity and selectivity of this aromatic nitrile. After years refining our crystallization and purification processes, we know this product by its CAS number 6147-64-8 and by the critical role it plays beyond the drawing board.
We manufacture 3,4,5-Trimethoxybenzonitrile with a sharp eye for quality. It forms a white to off-white solid, melting in a narrow, predictable range that signals proper purification. A boiling point of roughly 172–173°C at 17 mm Hg aligns with accepted literature and offers stability for reaction planning. Because trace impurities can complicate finicky organic synthesis, we run GC and HPLC checks on every lot, pushing for a purity specification from 99% minimum up to 99.5%, depending on the end use.
Scalability looks different in a chemical plant than in a catalog. We can consistently deliver this compound in volumes reaching multi-metric ton lots without shifts in crystal morphology or residual solvent profile. Our dehydration steps take alcohol and water levels down to what high-end synthesis demands. Before we clear a drum for shipment, we view representative samples under polarized light, confirming every shipment matches expectations, from a handful of kilos to truckloads.
Our method for making 3,4,5-Trimethoxybenzonitrile prioritizes reliability. Over time, we’ve moved from smaller glassware to dedicated stainless systems, because we know moisture control and clean condensation lines translate to better yields. We stay with a modified Sandmeyer approach, starting from 3,4,5-trimethoxyaniline, favoring copper(I)-assisted cyanation under controlled cooling to get fine, pale crystals instead of sticky tars. By selecting the right solvent system and layering in purification after isolation, we pin down lot-to-lot uniformity—chemists at the bench notice when filtration goes easy, and that’s no accident.
Each reactor addition can affect the flavor of side-products, so we keep an engineer present for pH and reservoir temperature throughout the run. The last thing you want is inconsistent conversion or lingering notes of starting amine. We’ve dialed in vacuum parameters during drying, so even at scale, every drum leaves the plant as dry, needle-shaped material that scoops out cleanly, not as a compacted brick.
Our largest regular shipments of 3,4,5-Trimethoxybenzonitrile go directly to manufacturers of pharmaceutical building blocks. In that world, every percentage point of purity affects downstream catalytic steps—especially in Suzuki or Heck cross-coupling. Some clients ask for custom micronization for slurry compatibility; we’ve produced several lots this way and get the importance of consistent particle size when dispersion is mission critical.
It plays a key role in specialty dye synthesis and some advanced polymers. Research and pilot groups developing new organic semiconductors request this compound for its electron-rich aromatic system combined with readily modifiable nitrile function. Custom functionalizations, such as lithiation at low temperatures or Grignard addition, benefit from a clean, high-purity starting point. Cases where trace amines or low-level inorganic salts remain can ruin an entire run for downstream functionalization—so our QA team views every gram as part of our customer’s investment.
Many operators have used 4-methoxybenzonitrile or 2,4,5-trimethoxy analogs, but the unique tri-substitution pattern on the benzene ring of this molecule delivers stability and predictable reactivity profiles not always found elsewhere. The additional electron-donating groups help it react faster in nucleophilic aromatic substitutions, shaving hours from certain steps.
Some suppliers claim broad compatibility or one-size-fits-all grades for benzonitrile derivatives. That doesn’t always translate to lab results. Our clients pursue tight molecular weight distribution or trace-level impurity suppression, often because their catalysts tolerate little deviation. We run side-by-side reactions using benzonitrile, 4-methoxybenzonitrile, and this triple-methoxy version—watching product conversions shift and yields change mark the difference. We have run in-process NMR to confirm reduced side-reactions, which translates into cost savings and reduced waste disposal needs for our industrial partners.
No chemical is “easy” when handled at scale, and 3,4,5-Trimethoxybenzonitrile is no exception. As a solid, it doesn’t absorb water from the air the way lower nitriles do, but we’ve watched plant humidity levels all the same. Cold months sometimes bring static concerns during drum transfers, so we ground equipment and review each handling procedure with operators. These steps are not about show; they avoid product loss and line shutdowns.
Each season brings its own quirks. Summer heat and warehouse airflow change how the drums stack and how product settles, so we’ve built in regular warehouse audits. The open-air transfer through conveyance funnels gives us a front-row view on caking risk, driving us to adapt our drum liners and offer resealable lidding—all based on real-world logistics, not assumptions.
Chemists working in active pharmaceutical ingredient (API) synthesis use our 3,4,5-Trimethoxybenzonitrile as a precursor for intermediates like 3,4,5-trimethoxybenzaldehyde, trimethoxyphenylacetic acid, and their corresponding alcohols. In one route, clients run selective reduction, converting the nitrile directly to an amine or aldehyde depending on catalyst and workup. Those running heterocycle formation remark on cleaner transformations starting from this compound compared to its mono-methoxy relatives.
Researchers in advanced materials development point out that the meta- and para-methoxy pattern keeps the aromatic ring activated to a degree that suits custom ligands or resin modification steps. Its high purity prevents catalyst poisoning or uncontrolled side reactions. We’ve even supported overlook production of rare fine chemicals, where a single impurity can disrupt days of work, by keeping our synthesis and QA documentation open for customer review.
With sufficient headroom on purity, post-synthetic operations—whether for amidine formation, nucleophilic aromatic substitution, or directed ortho-metalation—proceed more smoothly. Labs confirm by GC-MS, and our years of side-by-side feedback loop with process chemists have pressed us into new purification steps. Every feedback call leads to better control, not just for us, but for partners who need low-odor, reproducible material in every drum.
On the technical side, large plants using batches upward of 100 kg take our standard 99% purity grade, comfortable in their bulk operations, where slight residuals of trimethoxybenzene or trace copper catalysts do not impact final product specifications. For R&D and pharmaceutical synthesis demands, we shift to 99.5% or even 99.9% lots, running extra distillation and column cleanups, because at that level, even fractions of a percent matter to downstream enantioselectivity or final batch analysis.
Past attempts to save time by substituting a lower-purity grade showed us more returns and troubleshooting work; we’ve handled reports where a persistent impurity in an incoming lot delayed entire reaction campaigns. Now, every drum gets a reproducible test and periodic sampling from packed shipments. In roundtable reviews with our technical partners, the consensus has always favored a little extra investment in higher purity rather than risking batch inconsistencies or unnecessary reruns.
Making 3,4,5-Trimethoxybenzonitrile generates by-products; we collect every stream and treat spent solvents in compliance with our regional waste standards. Packing residues for proper incineration, monitoring vent scrubbers, and tracking every kilogram that comes off the reactor mean smoother audits and better community safety. In our facility, powder containment gets top priority, and we designed extraction hoods and self-closing bins to minimize dust loss and occupational exposure.
Feedback from our operators shapes our risk planning. Providing air-powered drum lifts and ergonomic dispensing keeps everyone safer and shortens loading times. Plant teams run routine fire drills and static discharge testing because we want every shift, not just the first, to get home safely.
On the environmental end, we adjust cooling water consumption seasonally and reuse purified water in process steps where possible. Each load of solid waste gets documented for origin, mass, and final disposal point; this diligence earns long-term trust from clients and community regulators alike.
From our vantage point, manufacturing is not about re-labeling a commodity chemical. We spend months dialing in every parameter, from raw material selection to finished goods testing, because a small change in impurity profile or particle distribution ripples out through every downstream reaction. Our operators arrive early, calibrate their gear, and call out even a whiff of off-odor or unfamiliar coloration. Chemists at the reactor line want predictable, sharp-melting material that dissolves cleanly and leaves no sticky residues behind.
Years of working with API and fine chemical partners have taught us the costs hidden behind subpar intermediates: higher solvent use, product recalls, and line downtime in the worst cases. We test in our own reactions before each batch leaves the facility, and our best recommendations come from troubles solved, not just certificates and data sheets.
Instead of neutral assurances or catch-all guarantees, we encourage process chemists to share scanned chromatograms or minor complaint notes. Each one helps us close the gap between industrial scale and lab requests, pushing us to refine processes for real-time results rather than theoretical claims.
Over the years, people have tried to swap in 4-methoxybenzonitrile or 2,4,5-trimethoxy analogues for some reaction steps, especially when high-volume commodity pricing tempts the supply chain manager. Yet, we see the knock-on effects: slower reactions, incomplete conversion, or uncharacteristic colored side-products. The stability of this compound supports high conversion rates in most cross-coupling protocols, and the methoxy groups enhance performance in electron-rich cyclization steps.
Structurally, its meta- and para-substitution pushes electron density into the ring, giving an activation pattern not easily replaced by less-substituted versions. In classical Friedel-Crafts or palladium-catalyzed coupling, we watch yields climb and purification steps shorten compared to analogs. Manufacturers working with 3,5-dimethoxybenzonitrile report more side-reaction products and less selective performance in their key steps.
Attempts to use commodity-grade single-methoxy benzonitriles often triggered late-stage purification challenges, pulling added cost from extra silica and solvent. On larger volumes, our customers see the difference as lower waste per batch, improved reproducibility, and fewer costly production holds due to trace carry-over.
We know every truckload of 3,4,5-Trimethoxybenzonitrile represents weeks of planning, especially when downstream schedules are tight. By staying close to process chemists, we can adjust drying or particle sizing, and we routinely flag the rare off-spec batch before it ships. For those who need custom safety documentation or chain-of-custody checks matching pharma or electronics suppliers, we print detailed batch passport packets with chromatography, melting point, and water/ash content for every shipment—not just upon request.
Batch-by-batch variation disrupts entire process trains, so we keep redundancy in our purification and quality control sections. Should a lot drift off spec, we promptly alert and offer tighter sieving, extended drying, or expedited resynthesis—whatever gets the customer back on line faster, not just what fits our schedule.
A strong production history with this compound also means we catch little troubleshooting details before they escalate. Operators spot color drifts or caking at repack and flag lot numbers for additional checks. Our in-house labs retest random units against the original QC certificate for ongoing verification, supporting recorded traceability for every kilo produced.
Having handled everything from multi-gram R&D prototypes to full cargo lots, our team respects how a trusted supply of 3,4,5-Trimethoxybenzonitrile supports project timelines and cost control. Our stock planning includes safety reserves specifically earmarked for repeat clients, so last-minute scaling or expedited requests don’t derail production. Real steady supply, not promises on a purchase order, grounds every contract.
We have walked customers through planning for inventory surges and unexpected delays. By running production a month ahead and rotating stock in climate-controlled warehouses, we hold down risks of supply interruptions. That discipline means production chemists aren’t throttled by shortages or forced to switch to less suitable analogs. Our logistics teams coordinate with customs agents and compliance officers to keep every shipment moving with minimal downtime.
In feedback sessions with international partners, the value of having a direct manufacturing source stands out. Being able to address delivery, quality, or documentation challenges in real time—not through middlemen—builds trust that outlasts any single batch or contract.
Every synthesis campaign teaches us something new, especially in handling compounds like 3,4,5-Trimethoxybenzonitrile at scale. We continually review our solvent recovery and emissions treatments to keep environmental impact low. By keeping lines of communication open with chemists and production managers, we adapt our processes—not in response to one-off complaints but by tracking trends across numerous production cycles.
Better quality monitoring, more precise purification, and easier shipment handling stem directly from caring about each step rather than treating product as generic feedstock. Our approach brings both scientific rigor and practical insights—earned with every run, every lot packed, and every feedback loop. The end result supports our customers’ progress on the front lines of pharmaceutical discovery, advanced materials design, and novel organic syntheses.
For us, 3,4,5-Trimethoxybenzonitrile is more than a line item—it's a workhorse developed through daily care, lab feedback, and decades of cumulative knowledge on plant floors and in QC labs.