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Methyl 2-Hexylacetoacetate

    • Product Name Methyl 2-Hexylacetoacetate
    • Alias hexylacetoacetatemethyl
    • Einecs 249-993-5
    • 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

    392902

    Cas Number 68535-76-2
    Molecular Formula C11H20O3
    Molecular Weight 200.28 g/mol
    Iupac Name methyl 2-hexyl-3-oxobutanoate
    Appearance colorless to pale yellow liquid
    Boiling Point 133-135°C at 13 mmHg
    Density 0.945 g/cm³ at 25°C
    Refractive Index 1.434-1.438 at 20°C
    Flash Point 110°C
    Solubility insoluble in water, soluble in organic solvents
    Purity typically ≥98%

    As an accredited Methyl 2-Hexylacetoacetate factory, we enforce strict quality protocols—every batch undergoes rigorous testing to ensure consistent efficacy and safety standards.

    Packing & Storage
    Packing The chemical "Methyl 2-Hexylacetoacetate" is packaged in a 500 mL amber glass bottle with a secure, tamper-evident cap.
    Shipping **Shipping Description:** Methyl 2-Hexylacetoacetate is shipped in tightly sealed containers, protected from moisture and direct sunlight, under ambient temperature. Handle with care to avoid spills. Transport in compliance with local, national, and international regulations for chemical substances. Consult the Safety Data Sheet (SDS) for specific shipping instructions and hazard classifications.
    Storage Methyl 2-Hexylacetoacetate should be stored in a cool, dry, and well-ventilated area, away from sources of ignition and incompatible materials such as strong oxidizers. Keep the container tightly closed and properly labeled. Avoid exposure to direct sunlight and extreme temperatures. Store the chemical in a designated chemical storage cabinet, preferably for flammable or organic compounds, and follow standard safety protocols.
    Application of Methyl 2-Hexylacetoacetate

    Applications of Methyl 2-Hexylacetoacetate in Industrial Manufacturing

    Methyl 2-Hexylacetoacetate serves as a specialized intermediate in diverse chemical production sectors. Our manufacturing expertise enables its integration into advanced industrial workflows where reliable quality, regulatory alignment, and precise formulation parameters are required for downstream value-adding. Below, we provide detailed application pathways, compliance guidance, and process insights for established sectors utilizing this raw material.

    1. Fragrance Ester Synthesis in Fine Fragrance Formulations

    This raw material acts as a key building block in the synthesis of niche esters for fine fragrance concentrates. During transesterification and acylation, it delivers the desired backbone for producing complex aroma molecules, especially in fresh, green, or fruity olfactory accords where branched chain acetoacetates are essential for stability and lasting power. Industrial-scale perfumeries integrate this intermediate to manufacture aroma chemicals later compounded into eau de parfum and related licensed scent products.

    Industry compliance standards

    • IFRA Standards (International Fragrance Association)
    • REACH (EC 1907/2006) for chemical safety in Europe
    • Cosmetic Ingredient Review (CIR) safety guidelines
    • US FDA 21 CFR Part 710 for cosmetic ingredient registration

    Typical usage ratio

    • Formulators employ 1.0–4.5% as a synthesis intermediate in batch fragrance ester production, with concentration optimized based on target ester profile and downstream olfactory testing.

    Downstream process integration

    • Charged during aroma molecule synthesis via acetoacetate pathway before final distillation and purification, then compounded into fragrance mix bases.

    Final product types

    • Fine fragrances (eau de parfum, eau de toilette concentrates)
    • Personal care scent compounds
    • Home care fragrance oils
    • Specialty aroma chemicals for F&F formulation

    2. Agrochemical Intermediates for Selective Herbicide Synthesis

    Our production supports the crop protection industry by supplying this acetoacetate as a critical intermediate in the synthesis route for specific pyridine- and phenoxy-based herbicides. It reacts in controlled condensation steps to introduce functional alkyl side chains, which enhance the efficacy and selectivity of the final active ingredients, particularly in systems targeting broadleaf weeds.

    Industry compliance standards

    • FAO/WHO specification for pesticide technical material
    • ISO 9001:2015 production management
    • Directive 2009/128/EC for sustainable pesticide use in the EU
    • EPA FIFRA guidelines for active ingredient registration

    Typical usage ratio

    • Batches typically utilize 2–7% by weight in the initial acetoacetate condensation phase, with adjustment dependent on target molecule yield and process scalability.

    Downstream process integration

    • Charged to the primary synthesis reactor alongside reagents for ring closure, then subsequent chlorination or amination as the synthesis proceeds toward formulation of technical concentrate.

    Final product types

    • Selective herbicide technical active ingredients
    • Emulsifiable concentrate formulations for crop protection
    • Water-dispersible granule agrochemical products
    • Pre-mix herbicide formulations for broadacre agriculture

    3. Pharmaceutical Intermediate for Anticonvulsant API Synthesis

    API manufacturers utilize this acetoacetate derivative in multi-step syntheses for select anticonvulsant pharmaceutical actives. Its acyl functionality enables nucleophilic substitution, facilitating production paths leading to heterocyclic scaffolds indicative of next-generation anti-epileptic agents. Comprehensive validation ensures that critical process parameters and raw material traceability meet strict pharmaceutical requirements.

    Industry compliance standards

    • ICH Q7 GMP Guide for Active Pharmaceutical Ingredients
    • Ph. Eur. (European Pharmacopoeia) Monograph specifications
    • 21 CFR Parts 210 & 211 (US FDA cGMP requirements)
    • DMF (Drug Master File) support documentation for regulatory filing

    Typical usage ratio

    • 0.5–2.0 molar equivalents, calculated based on stoichiometry for the targeted synthetic route and isolated API yield optimization.

    Downstream process integration

    • Added at heterocycle ring construction stage prior to final crystallization and purification steps, with rigorous in-process QC of purity and residual solvents.

    Final product types

    • Active pharmaceutical ingredients for epilepsy/anticonvulsant drugs
    • Pharmaceutical intermediates for CNS therapeutic APIs
    • Bulk API supplied for tabletting and encapsulation
    • Registered APIs for regulated markets

    4. Polymer Modifier: UV-Resistant Coating Additives

    Specialty polymer compounders apply this raw material as a precursor for synthesizing UV-absorbing additives in the manufacture of outdoor stable coatings. Its long alkyl chain and diketone structure impart the required compatibility for melt blending and enable the derived additive to disperse uniformly throughout acrylic, polyurethane, and other thermoset matrices, directly improving weathering and color retention.

    Industry compliance standards

    • EN 71-3:2019 (Safety of toys – migration of certain elements), applicable for exterior coatings
    • ISO 9001:2015 for polymer compounding process control
    • RoHS Directive 2011/65/EU for restricted substance content
    • ASTM D4587 (Standard Practice for UV Exposure of Plastics)

    Typical usage ratio

    • 0.3–1.5% by total resin weight in masterbatch production, with dosage tuned to meet required UV resistance levels and compatibility checks during scale-up.

    Downstream process integration

    • Introduced during liquid additive synthesis, then as a masterbatch concentrate supplied for in-line mixing with clear or pigmented coating resins before extrusion or application.

    Final product types

    • Automotive and industrial exterior coatings
    • Weather-resistant plastic outdoor furniture coatings
    • Clear and pigmented architectural coatings
    • UV-stabilized powder coatings for building components

    5. Scented Consumer Care Base: Solvent and Fixative in High-Performance Air Care

    Cleaning and air care manufacturers incorporate this acetoacetate as both a high-boiling solvent and fixative in formulations requiring long-lasting scent diffusion. Its volatility profile supports even evaporation and prolongs fragrance release, validated in room sprays and odor-neutralizing gels distributed in regulated markets.

    Industry compliance standards

    • IFRA Code of Practice and Standards for home fragrance
    • US EPA VOC limitations for consumer products
    • California Proposition 65 for chemical exposure warnings
    • EU CLP Regulation (EC) No. 1272/2008 for hazard classification

    Typical usage ratio

    • 1.2–4.0% depending on base composition, fragrance oil type, and final product volatility requirements in both liquid and gel matrices.

    Downstream process integration

    • Dosed during premixing with fragrance concentrate and solvent system before emulsification and filling into consumer packaging lines with in-process compatibility and evaporation tests.

    Final product types

    • Room air freshener sprays
    • Odor-neutralizing gel beads
    • Automatic air care dispenser refills
    • Premium scented oil diffusers for retail and institutional use

    6. Intermediate for Specialized Organic Pigment Synthesis

    Methyl 2-Hexylacetoacetate contributes a controlled input in the preparation of diketone-based organic pigments for use in high-performance printing inks and plastics coloration. Its unique structure promotes strong chroma development and improved dispersibility in finished pigment crystals essential for stable color output in demanding industrial printing processes.

    Industry compliance standards

    • EN 71-9 (Safety of toys - organic chemical compounds)
    • ISO 8124-3 (Migration of certain elements in pigment use)
    • GMP for pigment preparation (as per FDA 21 CFR 178.3297 for indirect food contact)
    • REACH compliance Dossier for pigment intermediates

    Typical usage ratio

    • 0.8–2.2% by pigment batch, with process engineers adjusting for target hue intensity and solvent compatibility in the finished powder.

    Downstream process integration

    • Added at condensation/coupling stage, followed by isolation of pigment and subsequent milling with dispersants before sample QC and packaging.

    Final product types

    • High-performance inkjet and offset printing dyes
    • Color masterbatches for polyolefins and ABS
    • Solvent-based and water-based pigment pastes
    • Colored engineering plastic components
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    Certification & Compliance
    More Introduction

    Methyl 2-Hexylacetoacetate: A Manufacturer’s Perspective

    Understanding Our Product

    Methyl 2-hexylacetoacetate has always attracted interest across a range of industries. Straight from our production lines, we know its place as a valued building block in the world of specialty chemicals. The unique structure, featuring a methyl group joined to an acetoacetate backbone and modified with a hexyl side chain, shapes its role in synthesis and performance. From what years of hands-on blending, testing, and refining have shown us, the real story sits not only in its composition but in the reliability we back into every kilogram leaving our plant.

    This compound finds itself at the front of research and small to mid-scale manufacturing in pharmaceuticals, flavors, agricultural chemicals, and material science. Chemists select it for its soft reactivity: the acetoacetate group offers stable yet versatile functionality, while the hexyl chain brings hydrophobicity that can be precisely tuned according to process needs. Whether working in esterifications, cyclizations, or with Michael additions, many rely on its balance between reactivity and selective performance.

    Practical Specifications and Bench Experience

    We produce Methyl 2-hexylacetoacetate in batches monitored for consistent physical parameters and low impurity content. Color remains clear to pale yellow by design. Typical purity levels, measured by gas chromatography, anchor above 98%. Water content, a threat to stability and reaction specificity, stays under 0.1%—a target we sustain through vacuum distillation and careful container management.

    Our plant teams run small-scale and production batch quality checks at every stage. Each run means hands-on sampling, immediate analysis, and review of reactivity profiles—techniques that evolve from years of customer feedback and on-floor experience. We do this less for a marketing edge and more so our customers' chemists can plan workups and downstream isolation with confidence. The viscosity and pour behavior of each drum stems from maintained chain length and minimal residual alcohols.

    Logistics matter: by controlling the syntheses from raw ketone and ester input through finished material, we guarantee single-source traceability. We store products in sealed HDPE drums under nitrogen, guarding against hydrolysis and oxidative degradation even during long-haul transport. There’s no substitute for a drum that looks, smells, and flows the same every time it opens at a partner's site.

    The Function of Methyl 2-Hexylacetoacetate in Synthesis

    Our firsthand experience shows that the acetoacetate group performs reliably in C–C bond formation, both under base-catalyzed and acid-catalyzed conditions. Most regular users value the mild reactivity; the product neither rushes unwanted side reactions nor sits dormant in reaction media. This means that process chemists leverage it for alkylations, condensations, and as a masked diketone group, building up intermediate structures that underpin everything from crop protection compounds to high-performance dyes.

    The hexyl side chain brings moderate lipophilicity. That’s the edge over shorter-chain acetoacetates: in applications demanding oil solubility or where polarity must shift solubility out of aqueous phases, our compound steps forward. It can slip into nonpolar matrices, such as synthetic lubricants or fragrance bases, widening formulating latitude compared to smaller acetoacetate esters. We have witnessed customers switch to this variant simply because their blends resist phase separation over longer storage times or deliver better topical spread in personal care preparations.

    Distinguishing Features Compared to Other Acetoacetate Esters

    Plenty of chemists ask about differences between the methyl, ethyl, or butyl acetoacetates. Experience shows that small changes in ester or side chain structure change more than just the boiling point or viscosity; they reshape the reactivity, partitioning, and regulatory properties of the end compound. For instance, methyl acetoacetate, lacking the longer alkyl chain, remains more hydrophilic and volatile—and in some cases, this means it evaporates away or reacts too quickly.

    The addition of the hexyl chain sets a physical and chemical boundary for Methyl 2-hexylacetoacetate. This structure enables it to stay in oil phases longer, resist hydrolysis in water-rich recipes, and deliver sustained release in controlled delivery matrices. Many of our agricultural clients choose it for slow-release formulations, while others pursuing ink and pigment manufacturing turn to it because it solubilizes certain colorants more reliably than standard acetoacetates.

    Safety is always discussed at the bench and in our safety meetings. Based on our experience, the added size gives the product a higher flash point than methyl acetoacetate and slightly lower volatility. This helps plants keep working conditions stable and reduces risks associated with vapor exposure, especially in closed-system reactions.

    Real-World Applications From Our Factory Floor

    We have seen Methyl 2-hexylacetoacetate’s role grow in pharmaceutical intermediate synthesis. Complex chiral centers and heterocyclic rings often demand acetoacetate chemistry, but not all acetoacetates deliver equal yield or purification ease. Our partners in fine chemistry push for cleaner profiles and tighter molecular weights, which we meet through years of process adjustment and custom purification steps. Each time a buyer mentions shorter column runs or a step skipped in solvent extraction, it validates our dedication.

    In flavors and fragrances, the subtle scent and blending properties of Methyl 2-hexylacetoacetate add depth to bases. The hexyl group avoids overpowering top notes while tying together more volatile aromas and stabilizing them in long-lasting compositions. We routinely collaborate with formulators who require not just purity but consistent aroma carries from lot to lot—a feature that matters most when smell and taste directly represent product value.

    Paints, coatings, and surface treatments open a different set of needs. Chemical engineers have pointed out that pigmentation suspension and leveling both improve using this molecule compared to shorter-chained esters. Our laboratories run fluidity and settling tests, and the results favor this ester in reducing sedimentation rates and preventing early crusting on application surfaces. Feedback loops between us and paint manufacturers sharpened our understanding by every returned drum and recommissioned blend.

    Seed treatment and agricultural protection show another side of the molecule. While formulations push for targeted delivery and environmental safety, the controlled release and low water solubility offered by this ester help active ingredients stay on the surface or root system longer. We worked with agribusiness clients to match rate of hydrolysis and bioavailability to growing season and weather—an adjustment made possible by our coordinated in-plant and field testing.

    Process Control and Customization

    From the manufacturing side, tailoring specifications arises from direct work with customer process chemists. Some users require an even tighter water specification, others a specific refractive index or color limit. Since we control each phase—from sourcing, through reaction, to purification and packaging—modifying upstream conditions or tweaking downstream purification becomes part of our daily routine. We welcome sample runs and pilot batches, tracking results tightly and tweaking for every new requirement. It’s hard-won trust, built one project at a time.

    Production shifts over the years have included everything from new catalyst blends to energy-saving distillation methods. Environmental responsibility draws as much attention as product outcome: by implementing solvent recycling and improved venting, waste and emissions both dropped. Direct investments in employee training, on-site testing, and advanced spectroscopy grant our teams the ability to spot drifts and intervene before they leave the plant.

    Quality Assurance: Lessons Learned

    Lab results tell only half the story. Over decades, analysis of customer complaints, in-field stability failures, and even accidental leaks taught us that robust quality assurance ties together production excellence with downstream reliability. This means tighter sampling schedules, equipment calibration checks, and real-time reporting—habits that spring from past mistakes and a deep-rooted drive to do better.

    Raw material control starts from pairing each truckload of input with incoming analysis. Batch records ensure traceability from supplier to finished drum. Our operators, no strangers to long hours and challenging setups, catch off-spec material before it passes on—because every missed detection means potential rework, lost efficiency, or worse, a delay for a customer relying on a smooth batch release.

    Recordkeeping does not just serve regulation; it serves our own learning. Reviews after every run feed back into process guides and emergency protocols, making sure past disruptions shape future smoother work. This builds a culture where information flows from floor workers to management, and each improvement finds its way into the next batch.

    Sustainability and Regulatory Adaptation

    Running a robust manufacturing operation means constantly meeting shifting environmental, health, and safety rules. Decades ago, solvent volatility and waste generation mattered little; priorities now rest on lifecycle impacts and regulatory registrations. Methyl 2-hexylacetoacetate faced its own share of documentation hurdles in supply chains serving global markets. Early on, we focused on meeting REACH and GHS standards, putting in the hours and resources to compile registration dossiers and product stewardship guides.

    Recent years brought heightened attention to carbon footprint and product end-of-life. To lower both, our processes invest in energy recapture, by-product recycling, and closed-loop water streams. We've replaced certain legacy raw materials with greener alternatives after persistent trials—never settling until performance matches old standards. Doing so means our partners get product that matches not only technical needs but also cuts environmental risk at each link of the chain.

    Practical Challenges and Solutions

    Acetoacetate chemistry never plays out just on the blackboard or in a spreadsheet. Real-world issues—from variable raw material quality during growing seasons, to container shortages, to transportation delays—create obstacles that demand real-time adaptation. Engineers, operators, and lab staff structure response plans based on experience. Letting off-spec raw material into the reactor never brings good outcomes, so we invest in spot checks and back-up suppliers. When weather disrupts supply lines, coordination across scheduling, production, and logistics minimizes downtime.

    Packing and transport carry their own lessons. Container selection, purging, and storage all shape end-user experience. Failures in one drum can cast doubt on an entire shipment. As issues like drum swelling or unexpected water ingress surfaced over the years, we shifted to double-sealed HDPE drums under dry nitrogen—an upgrade that cut site complaints and claims significantly. Fielding support calls and reviewing site visit notes keep us tuned into what works best overseas or in high-temperatures or moisture-prone regions.

    Process safety takes ongoing vigilance. The esterification route to Methyl 2-hexylacetoacetate creates intermediates sensitive to over-heating and catalysis, especially at larger scales. Real accidents anchor awareness; near-misses find their way into safety audits and ongoing employee training. These practical steps—cross-checked recipes, hands-on shift logs, active monitoring—reduce risk not just for our plant, but for every site downstream that taps our material.

    Working With Customers: The Real Value

    Chemistry does not happen in isolation. Winning and keeping customer partnerships goes beyond product alone—it grows from trust in batch-to-batch reliability, open communication, and responsiveness when needs shift suddenly. Relationships built through on-site visits, collaborative troubleshooting, and transparent support during product scale-up make the difference. Every time a partner’s pilot run leads smoothly into commercial production, or a technical problem finds prompt resolution, we know our team’s efforts matter beyond our own walls.

    For those scaling from laboratory to process scale, minor technical tweaks can mean the difference between a successful plant run and production bottlenecks. Our technical support teams, many drawn from the same backgrounds as our customers, know the pain points: sticky product, unexpected phase behavior, new compliance rules. Rather than send generic guidance, we work directly over email and on video calls, unpacking problems and tuning recommendations to the exact end-use. The best process improvements always spring from on-the-ground reality, shared plainly between chemist and manufacturer.

    It’s not about volume or sales, but about how predictable, stable materials help others innovate more smoothly and achieve their own technical and commercial goals. Each adjustment, every special lot, new analytical method, or customer-specific report arises from questions and feedback that reach us through daily work.

    Looking Forward

    The field keeps changing. Pharmaceutical regulations, sustainability standards, flavor and fragrance shifts—they all keep moving the bar. Our strategy stays focused on listening, investing, and adapting rapidly. For Methyl 2-hexylacetoacetate, we continue deepening our understanding of application-specific needs, welcoming visits, deploying sample runs, and supporting direct plant audits whenever they support better outcomes.

    One thing does not change: as manufacturers, we remain deeply involved in every drum and batch that leaves our site. Our livelihoods, reputations, and professional pride ride on how each partner views what we deliver. Open collaboration, applied learning, and steady attention to improvement anchor our methods. Those who use our Methyl 2-hexylacetoacetate know where it comes from, who stands behind it, and what kind of support they get along the way—for now and for the next challenges to come.