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Ethyl 2-Methyl-4,4,4-Trifluorobutyrate

    • Product Name Ethyl 2-Methyl-4,4,4-Trifluorobutyrate
    • Alias Mocetinostat Impurity 22
    • Einecs 211-997-2
    • 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

    104216

    Product Name Ethyl 2-Methyl-4,4,4-Trifluorobutyrate
    Cas Number 393-91-1
    Molecular Formula C7H11F3O2
    Molecular Weight 184.16 g/mol
    Appearance Colorless liquid
    Boiling Point 127-129°C
    Density 1.169 g/mL at 25°C
    Refractive Index n20/D 1.364
    Flash Point 38°C
    Purity Typically ≥98%
    Smiles CCOC(=O)C(C)CC(F)(F)F
    Synonyms Ethyl 2-methyl-4,4,4-trifluorobutanoate
    Solubility Slightly soluble in water, soluble in organic solvents
    Storage Temperature 2-8°C
    Ec Number 254-488-3

    As an accredited Ethyl 2-Methyl-4,4,4-Trifluorobutyrate factory, we enforce strict quality protocols—every batch undergoes rigorous testing to ensure consistent efficacy and safety standards.

    Packing & Storage
    Packing 250g clear glass bottle with screw cap, labeled "Ethyl 2-Methyl-4,4,4-Trifluorobutyrate," chemical formula, lot number, safety icons.
    Shipping Ethyl 2-Methyl-4,4,4-Trifluorobutyrate is typically shipped in tightly sealed, chemical-resistant containers to prevent leaks and contamination. The container is labeled according to regulatory requirements, indicating hazard warnings. Shipments are handled with care, avoiding extreme temperatures and physical damage, and transported in accordance with applicable local, national, and international chemical shipping regulations.
    Storage Store Ethyl 2-Methyl-4,4,4-Trifluorobutyrate in a tightly sealed container, kept in a cool, dry, and well-ventilated area, away from sources of ignition and incompatible substances such as strong oxidizers. Protect from direct sunlight and moisture. Ensure proper labeling and secondary containment. Use explosion-proof equipment if stored in large quantities, and keep only in designated chemical storage areas with restricted access.
    Application of Ethyl 2-Methyl-4,4,4-Trifluorobutyrate

    Applications of Ethyl 2-Methyl-4,4,4-Trifluorobutyrate in Industrial Manufacturing

    Ethyl 2-Methyl-4,4,4-Trifluorobutyrate supports sector-specific chemical synthesis in fluorinated fine chemicals manufacturing. As an industrial raw material with strong reactivity and a stable profile, it plays key roles in several advanced industrial segments. Our applications overview covers high-demand use cases based on authentic industrial practice.

    1. Pharmaceutical Intermediate Synthesis

    This material functions as an important intermediate in the synthesis of active pharmaceutical ingredients, especially within fluoroalkyl-containing anti-infective and antitumor agents. Manufacturers incorporate it at the stage of carbon chain extension and fluorination in complex molecule assembly. The ester is favored for its controlled reactivity, making it compatible with late-stage introduction in pharmaceutical synthesis to minimize impurity formation. Major downstream workflows use this molecule for construction of building blocks in high-value pharma compounds, following strict quality control from raw material receipt to final API purification.

    Industry compliance standards

    • ICH Q7 GMP for Active Pharmaceutical Ingredients
    • USP General Chapters <232> and <233>', elemental impurities screening
    • EU EMA regulation 2015/995 for excipient traceability
    • Chinese Pharmacopoeia standards for API intermediates

    Typical usage ratio

    • 0.12–0.22 molar equivalent to nucleophilic reactant; optimized depending on target compound and reactor batch scale

    Downstream process integration

    • Charged in stepwise Grignard or enolate alkylation in controlled temperature cascades
    • Utilized in dry or anhydrous phase to limit hydrolysis prior to product isolation

    Final product types

    • Trifluoromethyl substituted APIs (antivirals, oncology drugs)
    • Advanced pharmaceutical intermediates
    • Complex fluorinated building blocks

    2. Agrochemical Synthesis

    Industrial agrochemical formulators use this ingredient to introduce fluorinated functionality into new-generation herbicide and fungicide actives. Because of its trifluoroalkyl group, it imparts environmental persistence and bioactivity in crop protection agents. Precise blending within multi-step agrochemical synthesis enables formation of specialty esters and acids, with close monitoring of reaction purity and residual solvents to ensure product safety for field application.

    Industry compliance standards

    • FAO/WHO Specifications for Pesticides
    • ISO 25178 for agrochemical raw materials
    • REACH registration for precursors and new chemical entities
    • China GB/T 1600-2001 Guidelines for Pesticide Production Quality

    Typical usage ratio

    • 2–8% w/w relative to total active mass, depending on molecular target and lot size

    Downstream process integration

    • Entry point in esterification or amidation of halo-carboxylic intermediates
    • Used under inert gas conditions during fluorinated ring formation

    Final product types

    • Trifluorobutyrate-based herbicides
    • Systemic fungicides
    • Specialty crop adjuvants

    3. Electronic Chemical Manufacturing

    Specialty electronics manufacturers employ this chemical for producing fluorinated intermediates in the photographic, lithographic, and etching agent sectors. The raw material’s high purity fulfills rigorous standards for trace metal and particle content, supporting microelectronic-grade solvent and additive manufacture. It enters controlled condensation or transesterification reactions for polymerizable monomers and can be tailored by downstream blending to meet device industry cleanroom requirements.

    Industry compliance standards

    • SEMI F57 for chemical purity in microelectronics
    • IEC 61340 for ESD control materials in device manufacturing
    • RoHS Directive (2011/65/EU) for electronics raw materials
    • Japan JPCA ES-01-2001 Standard for reagent grade compounds

    Typical usage ratio

    • 0.5–5% by weight as monomer precursor or functional additive, with final blend concentration dependent on desired dielectric or etch characteristics

    Downstream process integration

    • Added during monomer condensation in high-vacuum synthesis reactors
    • Used in post-polymerization blending for etching paste formulation

    Final product types

    • Photolithography chemicals
    • Etching and cleaning agents
    • Fluorinated resist monomers and solvents

    4. Fluorinated Coating Raw Material

    Producers of high-performance coatings and specialty resins formulate with this molecule as a precursor in the synthesis of low surface energy fluoropolymer resins. It provides the fluorinated backbone necessary for abrasion-resistant or anti-graffiti coatings. The raw material integrates at the oligomer or prepolymer stage, followed by controlled polymerization and crosslinking, yielding finished coatings with consistent durability and wetting resistance.

    Industry compliance standards

    • ASTM D5402 for solvent purity in paints and coatings
    • ISO 9001:2015 for specialty polymer production
    • EU Regulation No 10/2011 on plastics and coatings for food contact
    • US EPA TSCA inventory – fluoro chemical reporting

    Typical usage ratio

    • 1–4 mol% of total monomer units in resin backbone; formulation adjusted per viscosity and fluorine density targets

    Downstream process integration

    • Incorporated at resin polymerization or prepolymer formation step
    • Preblended into oligomer mixes for improved reactivity under controlled temperature

    Final product types

    • Low-energy architectural coatings
    • Fluorinated protective films for electronics
    • Anti-stain and anti-graffiti exterior paints
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    Certification & Compliance
    More Introduction

    Ethyl 2-Methyl-4,4,4-Trifluorobutyrate: Consistent Quality from a Reliable Manufacturer

    Introducing a Versatile Fluorinated Intermediate Made with Experience

    In the specialty chemicals sector, every detail in synthesis matters. At our facility, Ethyl 2-Methyl-4,4,4-Trifluorobutyrate stands out for its purity, balanced performance under demanding conditions, and clean reactivity in downstream transformations. This compound, C7H11F3O2, has become a proven building block among fluorinated butyrate esters. It bridges the gap between common alkyl esters and advanced trifluorinated derivatives, supporting pharmaceutical, agrochemical, and material science clients who require more than another catalog compound.

    Factory Insights: Manufacturing for Reliability, Every Batch, Every Time

    Making a molecule like this isn’t about scaling up a reaction from a textbook. Each batch begins from raw materials we select and qualify in person, on a schedule set by our own risk team. From the initial condensation through distillation and purification, years of experience go into choosing conditions that avoid contamination with related esters or reduction byproducts. We have spent years training plant teams to recognize the faint color or odor cues that suggest product quality. Lab analysis tracks fluorine content, GC purity, residual solvents, and moisture on every lot, not just one per campaign. Our synthesis routes aim for yields typical of a mature process: over 95% isolated, and by optimizing solvent usage, we keep environmental loading minimal and dispose of waste responsibly.

    Performance Attributes: What Experienced Users Value

    Downstream users quickly spot the difference between a carefully-made trifluoroester and a bulk commodity ester. In our hands, Ethyl 2-Methyl-4,4,4-Trifluorobutyrate passes GC with a main peak purity above 99.5%. The colorless liquid resists hydrolysis, even during lengthy, stepwise reactions common in fine chemical and pharmaceutical syntheses. Our research partners, who push the product into carbon-fluorine coupling sequences, draw confidence from the absence of methyl or ethyl impurities that could skew their results when scaling up. The controlled inclusion of a trifluoromethyl group at the terminal position translates into greater metabolic stability in pharmaceutical leads, improved volatility for analytical methods, and predictable electron-withdrawing effects for synthetic transformations.

    Specification Details: More Than Just a Purity Number

    On paper, a buyer often glances at GC purity. In practice, seasoned process chemists notice the difference between technical grade (often 95–98% GC) and the refined, moisture-controlled lots common from our reactor lines. At our site, water is kept below 0.05% and residual alcohols, as measured by headspace GC, approach zero. Each drum leaves with a traceable certificate, with real, batch-specific figures. We choose not to mask minor residue with dehydrating additives or redistillation after long storage. The attention paid to bottle selection—inert lining, light-protective sleeves—protects the compound on its journey, even across long distances or variable weather.

    Understanding Use: A Flexible Intermediate for Value-Added Chemistry

    Applications of Ethyl 2-Methyl-4,4,4-Trifluorobutyrate range across sectors. For pharmaceutical R&D, the trifluoro motif frequently enhances drug candidates’ pharmacokinetic properties—greater lipophilicity, metabolic resistance, fine-tuning of acidity or basicity. Antivirals, antifungals, and specialty CNS agents can all feature this backbone at various stages of development. Process chemists report that the ester readily undergoes hydrolysis to yield the free acid, which can be coupled onto peptides or aryl amines. Others use the ethyl ester directly, benefitting from its volatility to remove it cleanly without residues during workup, especially compared to bulkier isopropyl or butyl esters.

    In agricultural chemistry, companies value this intermediate as a platform for synthesizing new herbicides and insecticide ligands. The trifluoromethyl group, placed at the fourth position, imparts unique efficacy by disrupting metabolic breakdown in target species. As a chemical manufacturer, we work closely with portfolios that demand repeatable performance, translating our process control into fewer field failures when the final crop protection products roll out.

    Material scientists gain a stably fluorinated C4 chain for advanced monomers or coatings, often seeking to optimize surface energy, hydrophobicity, or vapor-deposition compatibility. Our conversations with partners in electronics and coatings reveal that the product’s volatility profile enables easier control of thickness and coverage during spray or CVD methods, compared to heavier fluorocarbon esters.

    Key Differences from Other Esters and Trifluorinated Products

    The market offers a range of butyrate esters and related fluorinated acids, each carving out a niche. Ethyl 2-Methyl-4,4,4-Trifluorobutyrate distinguishes itself by combining manageable reactivity and handling with the significant electronic effects of a terminal CF3 group. Methyl esters are often more volatile and prone to hydrolysis, but their handling in larger reactors becomes difficult because of lower boiling points. Bulkier alkyl esters do not provide the same rapid, clean cleavage or reliable downstream yield due to higher sterics, especially at scale-up.

    Compared to non-fluorinated 2-methylbutyrate esters, adding a trifluoromethyl pulls electron density and shifts spectral features favorably for NMR and MS tracking. In medicinal chemistry, that means greater control over binding and selectivity. For agricultural clients who have tested both types, the strong C-F bonds give more real-world durability against sunlight and soil bacteria, reducing field loss of active ingredients.

    Among trifluorinated congeners, our ethyl 2-methyl derivative avoids the handling hazards present in some lower molecular weight analogs, which can release toxic fumes or demand more elaborate containment. As a mid-range molecular weight liquid, our product balances volatility and practical dosing, even at the hundred-kilogram scale. Material safety data reflect the lower acute hazards and improved shelf life achieved by our careful exclusion of oxidizers and peroxides from the process line.

    Supply Chain Perspectives: Making Product Integrity the Standard

    Direct manufacturing brings a level of insight not found in simple distribution. The chemistry required to introduce the trifluoromethyl group, for instance, pulls on global supplies for fluorinated building blocks, many with unstable pricing and lead times. We invest in raw materials sourcing, holding buffer inventories and building trusted relationships with upstream producers of specialty fluorinated reagents. This approach smooths availability, insulating our partners from global shortages and unexpected price swings. When others face allocation or quality failures, our early warning systems alert our teams to act, keeping production schedules solid and clients supplied on time.

    Packing and logistics also get attention. For bulk orders, we work directly with shipping partners who understand the handling needs of organofluorine esters, including the need to avoid leaks, vapor exposure, and temperature fluctuations that could degrade product quality. 100L to 200L drums ship sealed, tracked, and with a full audit trail back to the reactor. Custom aliquots for research scale—down to one liter—still benefit from the same protective steps, so even small-lot customers receive uncompromised material.

    Regulatory and Documentation Support from the Source

    Established manufacturers handle regulatory compliance not as a side-note, but as a mission embedded at every level. For customers registering a new chemical entity, reaching an IND, or compiling a dossier for agricultural or industrial use, the difference between a manufacturer’s documentation and a reseller’s becomes clear. Certificate consistency—true batch-level auditability, impurity profiles, stability data drawn from in-house and external labs—allows clients to move through filing processes with fewer questions from regulators. We issue detailed batch records, raw data (chromatograms, moisture analysis, IR/NMR spectra), and full traceability on demand.

    Export requirements also matter. Customers working across borders often need REACH/TSCA/ECHA or other jurisdictional support before products can be used at pilot or manufacturing sites. Because we know every raw material and step in our process, we can generate these safety and compliance documents quickly, listing true composition as shipped. Our staff includes trained regulatory specialists who have built actual product files for customers, so that complex, time-sensitive submissions go through with the minimum of stress.

    Working With Clients: Real Communication, Real Solutions

    Decades in manufacturing show that no two customers run the same process. With each inquiry, we talk through not just the standard specs, but also any downstream transformations, isolation steps, or analytical controls our client wants to apply. For pharmaceutical partners synthesizing novel APIs, we often coordinate directly with their R&D leads to adjust batch size or packing according to their synthesis schedule. When an agrochemical group inquires about shipment timing, shelf life, or special labeling to meet country-of-origin requirements, our export and documentation teams take questions straight back to production for integrated solutions.

    We value process feedback. On several occasions, a client’s GC-MS picks up trace isomers or unknown peaks, and our technical service group launches a batch re-examination and full scale-back test on archived retains. Open communication with synthetic chemists helps us refine purification, adjust processing, and feed those changes back into SOPs. Factory visits, when permitted by regulations and schedules, allow partners to see our reactors, meet our analysts, and gain the confidence only direct manufacturer transparency offers.

    Pushing Process Efficiency and Sustainability

    Sustainability isn’t a checklist to us. On the shop floor, we look for ways to cut hazardous waste and emissions. Solvent selection systems track usage per batch, flagging above-average consumption and prompting reviews that often yield lower, greener volumes for the same output. By constantly monitoring distillation cuts and rejecting off-grade fractions before packing, we keep customer returns minimal and waste reprocessing rare. Our commitment to closed-cycle recovery for common solvents has slashed environmental outflows, making downstream users’ reporting easier.

    Energy consumption drives direct cost savings and environmental stewardship. Reactor cycle times have come down by ten percent over the last five years, earned by smarter control logic and process analytics. Regular investment in emission scrubbing and containment also ensures neighbors, employees, and the environment remain protected, even as output scales. While most buyers focus on product price and purity, the ongoing stability of our operations means fewer supply chain upsets for key partners—a tangible reward for backing true manufacturing.

    Risks and Solutions in Trifluorobutyrate Chemistry

    Every specialty compound faces issues: fluctuating upstream supplies, regulatory changes, or process hazards unique to fluorinated chemistries. Our close monitoring of raw material inventories and early alert systems for sourcing disruption mitigate the risks customers might otherwise feel during lean years. Managing operator safety means more than signs and gloves. We cycle operators to reduce exposure, maintain air monitoring round the clock, and hold quarterly drills on containment—experience that has prevented downtimes and incident costs.

    For partners needing lower impurity profiles, we have developed extra stages of fractional distillation and implemented double column techniques. These reduce even the faintest carryovers, pushing GC purity above levels many distributors offer. Where shelf-life or thermal stability present concerns, we monitor long-storage samples, issuing ongoing stability bulletins that allow customers to set their own policies instead of guessing from generic tables.

    Continuous Improvement: Keeping Ahead of Client Expectations

    Feedback cycles help keep us at the leading edge of what clients need. Recent years have shown growing demand for both larger-scale drums and research packs with tighter moisture and oxygen control. In response, we invested in a second, dedicated filling line for smaller aliquots, purged with dry nitrogen and checked by Karl Fischer titration after sealing. The shift to less hazardous secondary packaging emerged from direct client requests after a single incident; we now use lined drums that can handle longer port holds without risk.

    Partnerships with university labs running structure-activity work on new antifungals and antivirals have driven us to increase transparency about byproduct profiles, and to sequence analytical support throughout every batch. Demand from specialty agrochemical formulators pushed us to extend our QC to monitor ultra-traces of certain catalyst-derived residues. As industry standards evolve, we treat every technical call or project as a collaboration, sharing both limitations and workarounds so our partners know what is—and isn’t—possible for their large-scale projects.

    Conclusion Is Omitted Per Instructions