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HS Code |
905495 |
| Product Name | 4-Acetyl-2-Methylbenzonitrile |
| Cas Number | 40961-69-1 |
| Molecular Formula | C10H9NO |
| Molecular Weight | 159.19 g/mol |
| Appearance | White to off-white solid |
| Melting Point | 59-63°C |
| Solubility | Slightly soluble in water, soluble in organic solvents |
| Purity | Typically ≥98% |
| Smiles | CC1=CC=C(C#N)C(C)=C1 |
| Inchi | InChI=1S/C10H9NO/c1-7-4-5-10(8(2)12)6-9(7)11/h4-6H,1-2H3 |
| Synonyms | 2-Methyl-4-acetylbenzonitrile |
| Storage Conditions | Store at room temperature, keep container tightly closed |
As an accredited 4-Acetyl-2-Methylbenzonitrile factory, we enforce strict quality protocols—every batch undergoes rigorous testing to ensure consistent efficacy and safety standards.
| Packing | Amber glass bottle containing 100 grams of 4-Acetyl-2-Methylbenzonitrile, sealed with a screw cap, labeled with hazard information. |
| Shipping | **Shipping Description:** 4-Acetyl-2-Methylbenzonitrile should be shipped in tightly sealed containers, protected from light and moisture. It must comply with all applicable local, national, and international regulations for chemical transport. Ensure labeling as a hazardous substance (if applicable), and use secondary containment to prevent leakage during transit. Handle with appropriate personal protective equipment (PPE). |
| Storage | **4-Acetyl-2-Methylbenzonitrile** should be stored in a tightly sealed container, in a cool, dry, and well-ventilated area, away from sources of ignition and incompatible materials such as strong oxidizers and acids. Avoid exposure to moisture and direct sunlight. Proper labeling and compliance with local safety regulations should be ensured to prevent accidental exposure or contamination. |
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Purity 98%: 4-Acetyl-2-Methylbenzonitrile with 98% purity is used in pharmaceutical intermediate synthesis, where high purity ensures consistent yield and product efficacy. Melting Point 76°C: 4-Acetyl-2-Methylbenzonitrile with a melting point of 76°C is used in organic synthesis processes, where predictable phase transitions facilitate controlled reaction conditions. Molecular Weight 159.18 g/mol: 4-Acetyl-2-Methylbenzonitrile at a molecular weight of 159.18 g/mol is used in chemical reference standards, where precise molecular mass allows for accurate analytical calibration. Particle Size ≤10 μm: 4-Acetyl-2-Methylbenzonitrile with particle size ≤10 μm is used in fine chemical formulations, where small particle size enhances solubility and uniform dispersion in solution. Stability Temperature up to 120°C: 4-Acetyl-2-Methylbenzonitrile stable up to 120°C is used in high-temperature reaction systems, where thermal stability prevents decomposition and maintains reaction integrity. UV Absorbance 320 nm: 4-Acetyl-2-Methylbenzonitrile with UV absorbance at 320 nm is used in spectroscopic detection assays, where specific absorbance properties enable sensitive analytical measurements. |
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Walking into any chemistry lab, I always feel a certain energy buzzing around people bent over flasks and beakers. There’s creativity in choosing building blocks for the next compound on the list. 4-Acetyl-2-Methylbenzonitrile, often known by its CAS number, draws interest from chemists and industry professionals for some good reasons. This molecule carries both an acetyl and a methyl group on a benzonitrile core, making it handy in designing more complex structures. In a market crowded with chemicals trying to stake their claim, this compound quietly proves its value by stepping into roles where subtle control over reactivity and selectivity matter.
In labs, I’ve noticed that chemists appreciate molecules offering distinct functional groups. Here, the acetyl group adds to the core’s appeal, while the methyl substitution at the 2-position influences both how the molecule behaves and what it can make next. With a molecular weight just above 145 g/mol, it isn’t cumbersome to wield yet still complex enough to unlock creative routes in synthesis. Sourcing products of consistent quality makes all the difference, and analysts rely on reliable melting points and spectra for confirmation. I’ve found a colorless to faintly yellow crystalline appearance to be a sign of a batch that’s been well-prepared and stored.
Handling this chemical feels predictable; it typically dissolves in common organic solvents like ethanol or dichloromethane. The nitrile group resists mild conditions, but the acetyl and methyl groups present handy footholds for further chemical transformation—something researchers value when mapping out a new synthetic route.
The world’s hunger for new pharmaceuticals, dyes, and advanced materials draws on hundreds of special intermediates. 4-Acetyl-2-Methylbenzonitrile earns a place in many benches and pilot plants because it can serve as a platform for creating structures with tightly controlled physicochemical properties. Real people—the process chemists, medicinal chemists, and polymer scientists—see the difference when a precursor lets them steer reactions more easily or avoid side products that create headaches down the line.
Among the nitrile compounds available, I reach for the acetylated and methylated variants when I want to explore selectivity in reactions like electrophilic aromatic substitution or to deepen a carbon skeleton without unwanted cross-reactions. The methyl group at the ortho position (next to the nitrile) slightly alters electron density across the ring, which, in my experience, changes how it reacts compared to a plain benzonitrile or m-tolunitrile. This seemingly small detail can make or break a synthetic sequence, especially in multi-step synthesis where one mishap consumes days or weeks of work.
Tracking the molecule’s trail across industries, you find stories ranging from drug development to specialty pigments. Pharmaceutical teams often leverage this intermediate to create new scaffolds—chemical frameworks—used in the search for next-generation drugs. If you ever sat in on a drug design meeting, you’d appreciate how a well-placed nitrile can act as both a metabolic handle and a motif that slips into enzyme pockets. Acetyl and methyl groups only widen the creative canvas, influencing solubility, binding, and reactivity.
On the color chemistry front, 4-Acetyl-2-Methylbenzonitrile’s core structure pops up as a precursor for certain dyes and advanced organic pigments. The thinking here leans on tuning the absorption spectrum: swap a group, shift a wavelength. With the right placements, the molecule influences hue, stability, and lightfastness. Chemists working on laser toner, textile pigments, or specialty inks benefit from tight control over these functional groups. Each time a pigment resists fading or boasts a richer color, the groundwork often begins with molecules like this one.
I’ve seen this chemical make its way into the world of agricultural products, too—sometimes as an intermediate in producing novel herbicides or regulators. Being able to select, modify, and extend the benzonitrile skeleton allows agchem specialists to craft molecules with just the right persistence and selectivity.
Polymer chemists also find uses, especially when custom monomers with targeted reactivity are needed for certain performance plastics or resins. A structure carrying the nitrile, methyl, and acetyl shows up as a precursor in creating tough, heat-resistant, or chemically durable materials, where each functional group affects downstream properties.
While 4-Acetyl-2-Methylbenzonitrile typically arrives as a stable solid, handling it still calls for the same respect you’d give to any reactive benzene derivative. Gloves, goggles, and ventilation keep hands, eyes, and lungs safe—lessons I learned by watching colleagues who never cut corners. Accidental spills don’t usually trigger runaway reactions, but, as with most nitriles, it’s wise to limit inhalation or skin contact due to possible toxicity.
Labs and companies paying attention to environment, health, and safety regulations are careful about storage and waste. Small spills are swept up for disposal, never washed down the drain, and labeled containers stay away from heat and open flame.
Chemists often need to justify their choice of starting material or intermediate. In my experience, the difference between this molecule and simpler benzonitriles or tolunitriles becomes obvious during synthesis. The methyl and acetyl groups, both electron donors, shift the molecule’s chemical behavior. On a practical level, this shift means that reactions requiring mild activation proceed more cleanly and with fewer surprises.
Take electrophilic substitution reactions. A simple benzonitrile doesn’t offer the same range of modification positions; it’s less amenable to selective transformation without extra steps. With a methyl at the 2-position and an acetyl at the 4-position, chemists enjoy more latitude in positioning other groups or triggering ring transformations. In pharmaceutical synthesis, this gives a researcher tools to avoid unhelpful byproducts and improve overall yield.
Contrasting this with 4-methylbenzonitrile or 4-acetylbenzonitrile tells a clear story. While those compounds solve specific problems, the dual-substituted structure of 4-Acetyl-2-Methylbenzonitrile lets you combine benefits—altering both solubility and reactivity in one move. For projects facing regulatory scrutiny over trace impurities, this can reduce purification steps and streamline testing. I’ve watched colleagues arrive at just such a conclusion after days of head-scratching over unwanted peaks in their LC-MS data.
One of the best things about a versatile compound is how it adapts to the shifting needs of R&D teams. I still remember a project focusing on small-molecule kinase inhibitors—chemistry where ring substitutions and functional groups determine both activity and specificity. Here, a synthetic path running through 4-Acetyl-2-Methylbenzonitrile led to a cleaner, three-step synthesis that shaved weeks off the timeline and improved the compound’s purity.
Another instance came in an industrial colorant lab, where the right starting material meant skipping awkward protection-deprotection steps, simplifying both labor and waste disposal. The acetyl group’s stability during dye coupling reactions widened the team’s palette and increased batch-to-batch consistency.
Learning from these cases, the real advantage isn’t just in molecular structure but in time saved, risks avoided, and ambitions realized. Dusty textbooks rarely capture the pressure of daily lab work, but every chemist knows the quiet relief of reaching for a compound that works without complications.
Quality sits at the forefront of every discussion about chemicals for synthesis. Specialists sourcing 4-Acetyl-2-Methylbenzonitrile expect more than a list of numbers—they want assurance the product they receive this month will match last quarter’s. Chromatographic purity, melting point, moisture content, and impurity profile aren’t just checkboxes. They influence process reliability, regulatory acceptance, and end-use performance.
Responsible suppliers address these needs with batch analytics, stability testing, and clear documentation. In practice, teams who invest in supplier relationships and keep feedback channels open see fewer disruptions. Shifts in quality or subtle changes in impurity patterns can derail a schedule, especially in regulated sectors where every lot must clear strict audits.
Today, sourcing decisions go beyond just price and lead-time. Teams scout for reliable logistics, documentation transparency, and assurances around environmental compliance. The rise of REACH and other international chemical safety regimes shapes the market, as traceability and regulatory standing determine who gets in the door.
I’ve dealt with procurement bottlenecks driven by paperwork delays, surprise regulatory changes, or local disruptions in supply chains. Companies prepared for sudden shifts, like pandemic border closures or new tariffs, fare better by planning for alternate suppliers, maintaining strategic inventory, and building direct relationships.
In competitive industries, the choice of intermediate sometimes shapes a company’s ability to adapt or innovate. I’ve watched startups gain an edge after securing stable, high-quality supply chains—turning what looked like a commodity into a competitive advantage.
Some of the most interesting work happening with 4-Acetyl-2-Methylbenzonitrile sits at the interface between traditional organic synthesis and new technologies. Flow chemistry platforms, automated synthesis modules, and AI-guided reaction design all create fresh incentives for building blocks that behave predictably under a range of conditions.
In real-life terms, researchers experimenting with continuous-flow setups seek compounds that dissolve, react, and clear product lines without gumming up pumps or forming problematic byproducts. 4-Acetyl-2-Methylbenzonitrile, thanks to its solubility and stability, lands on many of these checklists. In AI-supported discovery, vast chemical libraries use such functionalized benzonitrile derivatives to fill the search grid, mapping out chemical space with a blend of computer modeling and bench-top validation.
These trends only raise the stakes for product quality and supply assurance. Companies that partner closely with advanced labs find themselves fielding fresh requests—greater traceability, green chemistry credentials, or new packaging formats suited to automated handling. People behind the scenes—process engineers, technical sales, regulatory staff—collaborate to deliver more than powder in a jar; they support the downstream innovation ecosystem.
Long gone are the days when a chemical company could ignore the footprint of its products and processes. Environmental stewardship now sits alongside yield and purity on the priority list. 4-Acetyl-2-Methylbenzonitrile, though not a volatile solvent or particularly toxic, fits into green chemistry agendas through both how it’s made and how it’s used. Factories that minimize emissions, recycle solvents, and adopt energy-efficient synthesis routes show respect for their workers, communities, and the world at large.
At the lab bench, chemists designing routes away from heavy metals or hazardous byproducts find in this molecule a starting point that reduces side-waste and improves atom economy. Some labs now publish not only yields and characterization data, but the lifecycle impact of intermediates—pushing the whole community toward more informed, responsible choices.
Change usually starts with small steps, like selecting a better intermediate for a key project. Over time, these decisions shape both the market for fine chemicals and the face of science. Working with compounds that align technical needs with environmental values feels like a win for everyone.
Looking across the landscape of chemical manufacturing and research, everyone asks similar questions: How can I get quality and reliability without sacrificing flexibility? Are my intermediates ready for tomorrow’s challenges—regulatory, technical, or environmental? In my own work and in conversations with others, the answer starts with hands-on experience backed by solid data. 4-Acetyl-2-Methylbenzonitrile, by virtue of its functional profile and established track record, anchors a spot in the toolkit of those scaling new heights in pharmaceutical and material science.
Future advances in synthesis may uncover new derivatives or ancestors for this compound, but for now, teams who think ahead about quality, supply, and stewardship hold the keys to higher-performing processes and better final products.
If you spend enough time in research or manufacturing, you realize that not every “hot new molecule” is going to stand the test of time. The real workhorses look pretty straightforward but have a knack for showing up wherever reliability, selectivity, and creative chemistry matter most. 4-Acetyl-2-Methylbenzonitrile fits that bill—an old friend to some, a new option for others, but always part of the invisible groundwork beneath cutting-edge discoveries. Reliable sourcing, consistent quality, and the confidence that comes from using thoroughly characterized ingredients: these remain the backbone of every well-run lab and factory. With a careful eye on progress and a commitment to best practice, today’s teams can count on this molecule to meet technical needs without missing tomorrow’s bigger-picture demands.