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HS Code |
750427 |
| Product Name | Ethyl 2-Methyl-3-Hydroxy-4,4,4-Trifluorobutyrate |
| Cas Number | 104636-58-2 |
| Molecular Formula | C7H11F3O3 |
| Molecular Weight | 200.16 |
| Appearance | Colorless to pale yellow liquid |
| Boiling Point | Approx. 151-153°C |
| Density | 1.25 g/cm3 (at 25°C) |
| Refractive Index | 1.402 (at 20°C) |
| Purity | Typically ≥98% |
| Smiles | CCOC(=O)C(C)C(O)C(F)(F)F |
| Melting Point | -10°C (approximate) |
| Solubility | Slightly soluble in water, soluble in organic solvents |
| Storage Temperature | 2-8°C |
| Synonyms | Ethyl 2-methyl-3-hydroxy-4,4,4-trifluorobutanoate |
| Ec Number | None assigned |
As an accredited Ethyl 2-Methyl-3-Hydroxy-4,4,4-Trifluorobutyrate factory, we enforce strict quality protocols—every batch undergoes rigorous testing to ensure consistent efficacy and safety standards.
| Packing | Amber glass bottle, 100 grams, sealed with a screw cap, labeled with product name, CAS number, and hazard warnings. |
| Shipping | Ethyl 2-Methyl-3-Hydroxy-4,4,4-Trifluorobutyrate should be shipped in sealed, chemically-resistant containers, kept upright and tightly closed. Store and transport at ambient temperature, avoiding exposure to moisture and direct sunlight. Follow all applicable local and international regulations regarding the shipment of chemicals. Appropriate hazard labeling and shipping documentation are required. |
| Storage | Ethyl 2-Methyl-3-Hydroxy-4,4,4-Trifluorobutyrate should be stored in a tightly closed container, in a cool, dry, and well-ventilated area away from direct sunlight and incompatible substances such as strong oxidizing agents. Keep it at ambient temperature, protected from moisture. Ensure proper labeling and follow all institutional and regulatory guidelines for chemical storage and handling. |
Applications of Ethyl 2-Methyl-3-Hydroxy-4,4,4-Trifluorobutyrate in Industrial ManufacturingEthyl 2-methyl-3-hydroxy-4,4,4-trifluorobutyrate plays a pivotal role as an advanced intermediate in several high-value chemical manufacturing processes. This substance enables improved purity profiles and facilitates precise structural modifications in selected downstream sectors. Below is a detailed overview of principal industrial application scenarios based on our long-term cooperation with specialty chemicals, pharmaceuticals, agrochemicals, and material science industries. 1. Pharmaceutical Intermediate for Fluorinated Drug SynthesisMajor global pharmaceutical manufacturers incorporate this raw material into the synthesis of active pharmaceutical ingredients, especially in developing fluorinated analogs to enhance target specificity and metabolic stability. Controlled addition during key steps in multi-stage syntheses enables precise construction of chiral centers and side-chain functionalization crucial to patented drug molecules. The compound’s reactivity and compatibility support process yields, impurity minimization, and compliance with registration dossiers for regulatory submissions in North America, Europe, and East Asia. Industry compliance standards
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2. Agrochemical Intermediate for Herbicide and Pesticide Active Ingredient SynthesisAgrochemical formulators employ Ethyl 2-methyl-3-hydroxy-4,4,4-trifluorobutyrate as a building block in the production of advanced trifluoromethyl-containing actives, aiming for higher environmental stability and improved bioavailability. This compound participates in step-growth or chain extension reactions during the synthesis of new-generation herbicides and selective insecticides subject to international regulatory review. Close process monitoring ensures compliance with residue and impurity control in accordance with agrochemical registration protocols. Industry compliance standards
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3. Fine Chemical Synthesis for Fluorinated Monomer and Polymer ManufacturingSpecialty polymer producers utilize this raw material as a functionalized precursor to introduce trifluoromethyl branched motifs into high-performance monomers, co-monomers, or specialty resins. This delivers enhanced hydrophobicity, chemical resistance, and surface energy properties essential for performance coatings, membranes, and elastomeric materials. Controlled integration aligns with downstream demanding application standards in automotive, electronics, and engineered surface sectors. Industry compliance standards
Typical usage ratio
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4. Intermediate for Advanced Organic Synthesis and Fine ChemicalsCustom synthesis laboratories and fine chemicals producers apply Ethyl 2-methyl-3-hydroxy-4,4,4-trifluorobutyrate in chiral pool synthesis, oxidative coupling, or building block installation. Its functional handle positions enable construction of libraries for material science discovery, ligand manufacture, or precision organofluorine intermediates. Extended application covers resource chemical standards and high-purity reference substances for specialty research markets. Industry compliance standards
Typical usage ratio
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On the production floor, every new molecule tells its own story. Ethyl 2-Methyl-3-Hydroxy-4,4,4-Trifluorobutyrate has been the subject of much attention in the plant due to its niche capabilities in synthetic organic chemistry and pharmaceuticals. After years of producing both simple esters and highly specialized fluorinated building blocks, we have come to know that certain chemicals are game-changers. Ethyl 2-Methyl-3-Hydroxy-4,4,4-Trifluorobutyrate is one of those game-changers, and that reputation isn’t hype. Its structure offers a combination of reactivity, stability, and trifluoromethyl functionality you rarely see coming together in a single molecule.
Our team in synthesis knows that the purity and consistency of a compound like this often dictate the fate of entire reaction series on our customers’ lines. For reference, we prepare this compound with GC purity >98%, and NMR routinely confirms the chemical structure with both proton and fluorine signatures lining up specifically with the molecular design. We see a clear, colorless liquid with a faint ester odor. On a day-to-day basis, chemists in the QA/QC lab check for water content, verify color and refractive index, and track every batch from start to finish. Having built processes around real feedback from medicinal, materials, and agrochemical R&D labs, we also know when customers run into troubles with related esters: whether reacting too slowly, containing too much moisture, or bringing unexpected by-products that complicate purification.
Unlike more basic butyrate esters, this molecule’s three fluorines all locked on the fourth carbon give it a particular chemical resilience and shift its reactivity in predictable, but advantageous, directions. This means that whether you’re forming more complex fluorinated scaffolds, preparing pharmaceutical lead compounds, or introducing functional groups into plastics or advanced materials, you get less “background noise” from unwanted side-reactions. Unlike standard ethyl butyrate or methyl 3-hydroxybutyrate, the electronic effect of the trifluoromethyl group at the gamma position leads to a compound that resists base-promoted hydrolysis and remains stable in a surprising range of organic solvents. In our view, nothing replaces firsthand familiarity with batch performance, and that’s why continuous improvement isn’t just a slogan in our plant—it’s practical survival.
Use cases for Ethyl 2-Methyl-3-Hydroxy-4,4,4-Trifluorobutyrate keep expanding. In the pharmaceutical sector, research chemists reach for this molecule early in the process of synthesizing fluorinated drug candidates. Medicinal chemists have discovered that integrating a CF3 group at the gamma position can dramatically boost metabolic stability, alter lipophilicity, and improve the bioavailability profile of a lead structure. Our production runs for specialty pharma clients often begin with their feedback on impurity thresholds: we have worked closely with them to tune purification procedures and eliminate trace side products that block SAR studies or ruin scale-up.
On the academic side, synthesis groups tackle new transformations involving enantioselective reductions and functionalizations, often reporting to us their preference for the trifluoromethyl variant when compared to non-fluorinated analogs. Researchers report high selectivity due to the electron-withdrawing effect of the CF3 group, helping suppress over-reduction or unwanted reactivity at the beta-hydroxy position. This matches what our own process chemists have observed—batch to batch, you see fewer process hiccups with the trifluorinated version than with similar hydroxybutyrate esters.
Venturing beyond pharmaceuticals, its use in specialty chemicals and advanced materials really stands out. High-purity fluorinated butyrate esters like this offer unique properties in coatings, where hydrophobicity and resistance to environmental breakdown are prized. A specialty coatings manufacturer we work with reported a switch to our material after finding that traditional hydroxybutyrate esters degraded under UV-light and high humidity test cycles. In their case, durability in extreme settings made all the difference.
A lot of chemicals sound similar on a spec sheet, but real-world differences show during synthesis and downstream processing. We very rarely see side-product formation in alkylation or oxidation steps when starting from Ethyl 2-Methyl-3-Hydroxy-4,4,4-Trifluorobutyrate compared to non-fluorinated relatives. This brings fewer headaches to plant operators and smoother product isolation. Teams running gram-to-kilogram scales see that minor chemical quirks—like susceptibility to over-esterification or unwanted polymerization—just aren’t present. In high-throughput environments, this matters not only for product yield but for operational reliability. If a material gums up filters, clogs pumps, or breaks down unexpectedly, production goals don’t get met, and trust in the supply chain breaks down instantly. That’s not a theoretical issue; we’ve seen it, and it’s why we test every lot to real-world, not just analytical, standards.
Structurally, the difference boils down to the effect of the trifluoromethyl group on both chemical and physical properties. The bonds between carbon and fluorine resist cleavage, pushing up the molecule’s resistance to acids, bases, and even spontaneous decomposition. In practice, this gives you longer shelf life, fewer concerns around storage, and confidence that the key functionalities will still be there weeks or months after shipping. Handling at the plant, we notice spill risks are low thanks to minimal volatility under ambient conditions. This means both better worker safety and tighter environmental controls.
From the start, bringing this molecule into consistent commercial production required a new approach. Our process development teams spent over a year optimizing every step from raw material sourcing through final isolation to ensure that the trifluoromethyl group remained intact and didn’t lead to cost-prohibitive losses. Key learnings came from scaling up from pilot to full-plant campaigns: solvent choice, reaction temperature, work-up sequences, and storage all needed careful tuning. One of the largest gains came from identifying a more robust drying method—the earlier approach left trace moisture, which slowed reaction rates for some customers. Updated handling now gives water content lower than 0.05% in finished lots, according to regular Karl Fischer titration checks.
Our analytical team keeps a batch archive with NMR, IR, GC-MS, and HPLC results for every lot. These records are not simply printouts in a binder; they’re living documentation reviewed any time a customer reports even minor process deviations. This attention to detail flows from a culture that values on-the-ground knowledge—learning directly from the chemists and engineers who deal with unexpected challenges in the field and passing that knowledge back into production and QC at home base.
We don’t just ship the molecule and disappear. As research applications evolve, especially in fluorine chemistry, we stay in active conversation with the development leads and bench chemists using our products. Several collaborations with university groups have shown how swapping a regular ethyl 3-hydroxybutyrate for the trifluorinated version can flip outcomes in asymmetric synthesis, or reveal new mechanistic pathways that only become accessible through the electron-withdrawing effect of the CF3 group. We support these efforts not only by providing material, but by sharing data on stability, storage, and impurities built up over hundreds of runs.
It’s commonplace for customers to ask for technical insight they just don’t get from traders or distributors. We have run stability studies over the past three summers to track decomposition pathways at various temperatures and humidity levels just so researchers can confidently plan storage and use. No matter how many certifications or regulatory clearances a product might acquire, the most valuable insight always comes from actual use at real scale, and that is the voice we rely on to guide continuous improvement.
Ongoing production never means smooth sailing every day. Like all specialty intermediates, Ethyl 2-Methyl-3-Hydroxy-4,4,4-Trifluorobutyrate has at times revealed quirks that keep chemists on their toes. One recurring hurdle involved excess formation of a minor monoester impurity during scale-up, especially on hot and humid days. Lab tests didn’t catch it at first, but users downstream found mysteries in their GC traces. By switching to jacketed glass reactors and tighter environmental monitoring in our plant, we clamped down on this and reduced batch variability.
On the shipping side, packaging failures uncovered another lesson. Initial trial runs used seals ill-suited for aggressive fluorinated esters. Gasket swelling and trace leaks led to off odors and rare but real losses. Working with our packaging supplier (and after some trial and error with different resin formulations), we landed on a HDPE-based system that stands up to the molecule’s reactivity in transit. Since this change, annual wastage measures in single bottled digits, and feedback from clients using the material for medicinal and material syntheses shows they get what they expect, every time.
Regulatory landscapes keep shifting, and as a chemical manufacturer, we stay vigilant on international, national, and even local requirements. With the increased worldwide scrutiny on fluorinated chemicals, we maintain active documentation on effluent disposal, workplace safety measures, and product stewardship. Routine internal audits and close communication with regulatory advisors track shifts in policy, particularly those affecting shipping, worker exposure, and environmental release of organofluorine compounds. Our emission control systems have been updated in the past year, and regular reviews with suppliers double-check that every kilogram we produce and move fits current safety data profiles.
We’ve seen first-hand how both pharmaceutical and materials companies face delays if unexpected changes in local environmental rules put a pause on processing. Our clients rely on not just the chemical itself, but a supporting network that provides full, accurate, and constantly updated information on safe use, handling, and downstream application. By anticipating these needs and participating in industry groups focusing on responsible fluorinated chemistry, we add a layer of dependability that traders and occasional suppliers rarely match.
People often ask if the wider adoption of this molecule stems from its trifluoromethyl feature alone, but our experience says there’s more to it. In actual production, the presence of both a secondary hydroxy group and the CF3 moiety sets up a unique pattern of reactivity. Non-fluorinated hydroxybutyrate esters see more rapid cleavage under base, complicating any long-term or high-pH application. Where customers have used the non-fluorinated versions, feedback often covers surprise hydrolysis, decomposition, and sticky residue left in reaction vessels—added cost, lost time, and diminished reliability.
Switching to other fluorinated esters, for example, simple ethyl trifluorobutyrate, you lose the versatility brought by the hydroxy group at position three. Even small changes—such as moving the trifluoromethyl group or methyl branch—lead to altered boiling points, different stabilities, and ultimately changed reactivity patterns that just don’t fit the increasingly stringent requirements of pharmaceutical and material science synthesis. That’s practical information acquired through repeated side-by-side runs, not just catalog comparisons.
This market, centered on specialty and advanced intermediates, keeps evolving. Ethyl 2-Methyl-3-Hydroxy-4,4,4-Trifluorobutyrate sees increasing adoption by groups looking to meet fresh regulatory demands, pursue ever-more selective synthesis, and construct products that perform under punishing real-world conditions. Our focus as a producer falls on predictability, traceability, and the continuous adaptation of process and application understanding as feedback pours in from hands-on users. Reliable materials open doors for new therapies, advanced electronics, and high-durability coatings—the value chain starts with the people who manufacture base molecules you can count on to behave, batch after batch.
In today’s high-velocity research and manufacturing environment, shortcuts in documentation, testing, or customer support quickly show up as problems—either in end-product quality, missed deadlines, or lost trust. Our guiding principle is simple but relentless: listen for every bit of feedback, document every lesson, and let real-world performance drive our practices and innovations. The story of Ethyl 2-Methyl-3-Hydroxy-4,4,4-Trifluorobutyrate is, at its core, a blueprint for how new chemistry expands possibility through expertise, communication, and constant learning—not just in the molecule itself, but in the people who produce and power its use worldwide.