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4-Fluorobutyric Acid Methyl Ester

    • Product Name 4-Fluorobutyric Acid Methyl Ester
    • Alias Methyl 4-fluorobutyrate
    • Einecs 206-876-5
    • 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

    811942

    Chemical Name 4-Fluorobutyric Acid Methyl Ester
    Synonyms Methyl 4-fluorobutanoate
    Cas Number 460-04-0
    Molecular Formula C5H9FO2
    Molecular Weight 120.12
    Appearance Colorless liquid
    Boiling Point C 147-149
    Density G Ml 1.019
    Smiles COC(=O)CCC(F)
    Purity Typically >97%
    Refractive Index N20 1.411
    Storage Temperature C 2-8

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

    Packing & Storage
    Packing 250 mL amber glass bottle with airtight cap, labeled "4-Fluorobutyric Acid Methyl Ester," hazard symbols, and handling instructions.
    Shipping 4-Fluorobutyric Acid Methyl Ester is shipped in tightly sealed, chemically-resistant containers to prevent leaks or contamination. Packages are labeled with appropriate hazard information and handled per international transport regulations for organic chemicals. Temperature and transport conditions are maintained to ensure product stability, and documentation accompanies all shipments for regulatory compliance and safe handling.
    Storage 4-Fluorobutyric Acid Methyl Ester should be stored in a tightly sealed container, away from light, moisture, and incompatible substances such as strong oxidizing agents. Keep it in a cool, dry, and well-ventilated area, preferably in a chemical storage refrigerator or cabinet. Always ensure proper labeling and secondary containment to prevent leaks or spills.
    Application of 4-Fluorobutyric Acid Methyl Ester

    Applications of 4-Fluorobutyric Acid Methyl Ester in Industrial Manufacturing

    As a direct manufacturer focused on high-purity specialty esters, we deliver 4-Fluorobutyric Acid Methyl Ester for strictly verified industrial downstream sectors. This raw material finds established use in pharmaceutical synthesis, crop protection chemistry, advanced materials, and fine chemical intermediates. The following application breakdown outlines authentic usage cases, covering compliance, real-world dosing, processing, and finished products across each industrial segment.

    1. Pharmaceutical Intermediate Synthesis

    This material serves as a highly selective building block in the production of active pharmaceutical ingredients, particularly in the synthesis of advanced fluorinated drug candidates and custom fluorinated motifs for CNS and metabolic disorder therapeutics. Leading pharmaceutical facilities employ our product in critical coupling and chain-extension reactions where fluoroalkyl groups enhance pharmacokinetic and metabolic profiles, with adherence to route-specific regulatory standards at every stage.

    Industry compliance standards

    • Current Good Manufacturing Practice (cGMP) as per ICH Q7
    • United States Pharmacopeia (USP) and European Pharmacopoeia (EP) monographs for API intermediates
    • EU REACH registration and substance approval for intermediate use
    • Specific Drug Master File (DMF) referencing upon request

    Typical usage ratio

    • Commonly 0.2–1.5 molar equivalents relative to core substrate, adjusted based on coupling efficiency and desired fluorine content in the target molecule

    Downstream process integration

    • Introduced during the alkylation, acylation, or chain extension phases in multi-step pharmaceutical syntheses; frequently enters after initial scaffold assembly but prior to final API derivatization and purification

    Final product types

    • CNS active pharmaceutical ingredient intermediates (e.g., GABA analogs containing fluoroalkyl side-chains)
    • Specialty fluorinated antiepileptic compounds in clinical development pipelines
    • Oral and injectable drug precursors passed to formulation teams

    2. Agrochemical Active Ingredient Manufacture

    This ester is a direct input for constructing fluorine-containing heterocycles and aliphatic chains essential for modern herbicides and fungicides. Its transformation enables the production of molecules with increased metabolic stability, improved leaf penetration, and reduced phytotoxicity. Crop protection manufacturers employ stringent process controls to guarantee regulatory approval in global markets.

    Industry compliance standards

    • FAO/WHO JMPR Guidelines for pesticide active ingredient composition
    • ISO 9001:2015-certified management systems
    • National regulatory authorities such as U.S. EPA, China ICAMA, and EU Regulation (EC) No 1107/2009 for new active substances

    Typical usage ratio

    • 0.5–2.0% (by weight) in agrochemical precursor formulations, subject to stoichiometric requirements for ring-closing or chain-extension steps

    Downstream process integration

    • Feeds into pre-condensation or cyclization stages for synthesis of complex fluorinated pyrazoles, oxadiazoles, and other targeted structures

    Final product types

    • Technical grade fungicide components for broad-acre crops
    • Next-generation selective herbicides with 4-fluorobutyric moieties
    • Crop protection intermediates for global formulation plants

    3. Advanced Polymer and Specialty Material Synthesis

    Materials scientists utilize this fluorinated ester to tailor polymer side-chain functionality and impart unique surface or barrier characteristics. The compound integrates into specialty polyamides, fluorinated polyesters, and crosslinked networks, enhancing chemical resistance and lowering dielectric constants for precision electronics or membrane applications. Scrutiny under advanced quality regimes assures consistency at scale.

    Industry compliance standards

    • ISO 9001 and ISO 14001 certified quality and environmental management systems
    • RoHS 2011/65/EU and REACH Annex XVII restrictions (where applicable)
    • Internal customer-specific specifications validated by incoming QC and polymer property testing

    Typical usage ratio

    • 0.1–1.0 wt% for copolymerization feed, modulated based on target polymer chain length and final property profile

    Downstream process integration

    • Charged into the monomer mix or reacted during polycondensation/reactive extrusion with catalyst systems to control incorporation of fluorinated side-groups

    Final product types

    • High-performance fluorinated polyamide films for automotive/industrial use
    • Dielectric polymer resins for microelectronics encapsulation
    • Membranes and coatings requiring high chemical inertness and low permeability

    4. Fine Chemical Intermediates for Custom Synthesis

    Custom synthesis companies and contract manufacturers adopt this intermediate in tailored molecule construction, particularly where unique fluorine placement is vital. It acts as a molecular handle or source of chain extension in resource- and time-intensive fine chemical routes. Our strictly defined product specifications and full traceability enable seamless audits and batch-to-batch quality assurance for specialty projects.

    Industry compliance standards

    • ISO 9001:2015-certified QC and batch tracking systems
    • Full documentation package, including Certificate of Analysis (COA) and Material Safety Data Sheet (MSDS)
    • Customer-specific supply chain audits (as per CMO/CDMO agreements)

    Typical usage ratio

    • Elastic: 0.2–1.2 equivalents relative to custom starting material; adjusted based on route planning, desired substitution, and efficiency targets

    Downstream process integration

    • Introduced at intermediate synthesis phase for fluorinated building block assembly prior to final derivatization or cross-coupling

    Final product types

    • Specialty reference standards for analytical or academic applications
    • Custom functionalized intermediates supplied under contract for advanced R&D or pilot-scale production
    • Complex fine chemicals for flavors, materials, or molecular probe design
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    Certification & Compliance
    More Introduction

    4-Fluorobutyric Acid Methyl Ester: Reliability Backed by Industry Experience

    At the production line, care for every batch sets the final product apart. 4-Fluorobutyric Acid Methyl Ester (also known as methyl 4-fluorobutanoate) demands a precise process, one that calls for thorough purification, controlled reaction parameters, and attention to purity at every step. Direct experience tells us: Even slight deviations in temperature or reagent concentration influence resulting purity and stability. For research organizations, pharmaceutical companies, and agrochemical innovators, these small differences shape the baseline of every downstream result—reproducibility, yield, and overall value.

    Practical Model and Reliable Consistency

    We craft 4-Fluorobutyric Acid Methyl Ester with a focus on repeatability. Each lot typically presents as a clear, colorless liquid, with purity by GC exceeding 98% unless specified otherwise by the client. Moisture and residual acid levels receive close monitoring at each critical stage, and all data are traceable back to batch-level records. From years of direct feedback, most customers request a model with 99% GC purity, as it consistently supports research without interfering signals or unplanned side products.

    Applications in Modern Synthesis

    This compound steps in as a versatile building block in organic synthesis. Medicinal chemistry teams rely on it for constructing fluorinated analogs, where the fluorine atom provides metabolic resistance or modulates pharmacokinetics. Process chemists will recognize its utility in designing intermediates for active pharmaceutical ingredients, where the methyl ester group offers controlled reactivity—hydrolysis under mild or strong conditions, depending on need. Plant science groups use it in the creation or modification of agrochemicals, drawing on the unique traits imparted by the fluorine substituent on the butyric acid backbone.

    Production Choices and What Sets the Material Apart

    Few manufacturers handle this product from raw material to purified ester in-house. Some prefer to outsource steps, which brings risk of mix-ups, cross-contamination, or ambiguity about specific reagents and solvents in the chain. By running the entire synthesis and purification process ourselves, rigorous verification can take place at every intermediate, reflecting a commitment beyond external audit checks. This approach allows us to swiftly address any deviation in impurity profile, especially when a byproduct might interfere with bioassays or downstream functionalizations.

    Another difference comes from solvent handling. Standard approaches often result in trace solvent residues (sometimes unlisted), particularly DMF or DCM, which can cause downstream complications or interfere with scale-up reproducibility. Careful distillation, low-odor packaging, and vacuum drying minimize these traces. This attention came after specific customer reports—for instance, one pharmaceutical team logged an unexplained impurity in late-stage API work that traced back to solvent trapped in a methyl ester they sourced externally. Post-investigation, we refined our process to push residual solvents below 0.2%, meeting internal reference standards that are stricter than general pharmacopoeia requires.

    The Role of Purity in Project Outcomes

    No two applications treat starting material purity the same way. Some early-stage R&D collects broad data and tolerates side products; others working on clinical candidates require verification to the parts-per-million level. Purity, typically over 99% by GC with low residual acids (under 0.2%), means a clean baseline for pharmacological screening—no misleading side-effects, no off-target activity from unlisted contaminants. We monitor for key related substances: unreacted fluorobutyric acid, any methyl butyrate isomers, and low-level halogenated byproducts common in incomplete fluorination reactions. Early batches, before process optimization, revealed one such byproduct that impacted enzyme inhibition data. Acting on direct customer feedback and our own analytical runs, process tweaks brought these side materials well below industry tolerances.

    Repeatedly, end-users mention that a compound free of odor, yellowing, or “stickiness” tends to give more confidence during handling and formulation. The methyl ester group should remain reactive enough for planned transformations; no one wants unintended polymerization, acid-catalyzed side-reactions, or storage instability. These quality points come from repeated user input—not just theoretical knowledge or standard literature protocols.

    Usability and Reaction Profile

    4-Fluorobutyric Acid Methyl Ester behaves as an amenable intermediate—its methyl ester group allows standard transesterification, hydrolysis to acid, coupling, or reduction. Its functionality offers a stepwise control absent from the free acid, which can sometimes promote unwanted side reactions or decomposition in sensitive synthetic chains. Several collaborating research groups working on next-generation CNS drugs have reported that methyl esters give them the synthetic flexibility to move between protected and deprotected states with less yield loss than directly using the free fluorobutyric acid.

    During preparation for functionalizations—amidation, reduction, or Grignard reactions, among others—the isolated methyl ester endures moderate conditions, preserving the fluorine substituent. Direct experience with multiple downstream protocols, especially in scale-ups, emphasizes this stability. It tolerates moderate bases and acids without breaking down, provided dehydration and residual solvent levels stay low—yet again reinforcing the importance of a clean, well-documented manufacturing process.

    Comparison With Analogous Intermediates

    Choosing methyl 4-fluorobutanoate over other fluorinated compounds or simple butyric acid esters comes down to both performance and reliability. Methyl esters of non-fluorinated butyric acid offer predictable reactivity, but lack the unique properties fluorine provides. This often manifests as increased metabolic stability in drug candidates, or altered physicochemical properties in materials work. Among fluorinated options, longer-chain analogs or branched variants sometimes present handling difficulties (volatility, odor, solubility) or are less readily available in high-purity formats.

    Feedback from process chemists points to the difference in downstream ease: methyl 2-fluorobutanoate and methyl 3-fluorobutanoate, while related, often display higher volatility (posing storage hazards) or different reactivity, which can complicate scale-up batches. Our focus on the 4-fluoro analog speaks to market demand for cleaner, more manageable intermediates with well-mapped impurity profiles and clear physicochemical data.

    Handling, Stability, and Storage Best Practices

    Shelf life gains attention because research projects sometimes run for years from first trials to formal preclinical evaluation. We invest in clean glass containers and avoid plasticizers that could leach into the ester, especially over long-term storage at room temperature. Accelerated stability testing confirmed that samples held at 25°C in sealed, light-protected flasks maintained GC purity above 98% for six months, with only mild hydrolysis observed. Any hint of acidic impurity growth or ester scission triggers an immediate quality re-assessment, as these could affect results in late-stage synthesis or bioassay runs.

    Direct shipment feedback taught us that a solid outer carton and inner protection reduce transit damage and prevent accidental exposure. End users value a packaging design that allows easy withdrawal by syringe, minimizing bulk exposure and reducing contamination risks. Over months of discussions, these practical storage and handling choices became just as integral to product quality as analytical purity.

    Process Control and Analytical Methods

    In the early days, a reliance on standard TLC and low-sensitivity GC proved insufficient for full impurity control. Continuous method development led to adoption of high-resolution GC-MS and validated HPLC, both calibrated with internal standards matched to the target methyl ester. This commitment arose out of necessity—after one incident where sub-1% thresholds of an unknown late-eluting byproduct skewed downstream mass balance calculations in a partner’s process, we overhauled our detection limits and sample rotation protocols.

    In-house analysts run batch samples against reference standards from previous high-purity lots, ensuring day-to-day consistency. Certificates of analysis track key physico-chemical parameters such as refractive index, density, residual solvent, and relevant ion content. Cross-checking with NMR helps verify structure and exclude structural isomers, especially important in regions where byproduct formation rates can rise due to environmental factors in the plant.

    Supply Chain and Transparency

    Customers regularly ask about the provenance of raw materials, and for good reason. Traceability allows rapid problem-solving if impurities slip into the process—especially with fluorinated products where minor variations can have outsize effects on reactivity and safety. We source fluorinating agents and butyric acid domestically whenever possible, pairing this with full-partner transparency down the supply chain. This practice sometimes increases raw input costs, but a clear advantage comes in rapid response to inquiries, audits, or regulatory data requests backed by secure documentation.

    One important point: each year brings subtle changes in regulation, both for chemical manufacture and for import/export of fluorinated substances. Staying current requires weekly review of domestic and international guidelines (such as REACH or TSCA status if applicable) and active dialogue with industry groups and regulatory consultancies. Our documentation adapts as needed, but the principle remains—clear, accurate supporting papers for every client order, including data from our internal QC and any external verifications performed.

    Customer Input and Product Refinement

    No product improves in isolation. Recent feedback cycles identified a missed concern: residual acid content, although below general specification, interfered with a customer’s sensitive coupling reaction. As a result, we revised our purification sequence to include an additional neutralization and filtration stage, achieving even lower acid traces in the final ester. Several years ago, another client pinpointed a shelf-life inconsistency with one lot. Investigation traced the problem to a storage temperature deviation during internal transfer—a simple oversight, yet one that prompted a full revision of in-plant material handling procedures.

    We welcome and invite technical dialogue—experience shows that open discussions lead to faster resolution, fewer delays, and stronger results in the field or laboratory. The input received from technical, quality, and R&D groups directly shapes not only production, but also our packaging, documentation, and analytical priorities. Quality improvement is a living process, not a fixed endpoint.

    Addressing Supply and Scalability Concerns

    Growth in demand from biopharma and agrochemical development brings periodic supply chain challenges. Customers scaling up projects need reliable timelines. To support this growth, our plant moved to multi-ton capacity for most intermediates, including methyl 4-fluorobutanoate, following a careful review of reaction, isolation, and purification workflows. Root-to-finish processing under one roof reduces handoffs, lessens risk of mix-ups, and ensures strict control over every variable.

    On occasion, raw material shortages or logistics delays suggest the value of buffer stock and scheduled production windows tailored to client projections. We maintain open communication with business partners so that projected order sizes can be matched to plant scheduling, limiting the frequency of backorders or substitution with inferior batches. Throughout—no dilution or blending shortcuts, no reprocessed off-spec material cycles into finished goods. The focus stays on repeatable, reliable output batch after batch.

    Environmental and Safety Considerations

    With growing global awareness about environmental impact and safe waste handling, we continually adapt our process to minimize emissions and improve wastewater management. Methyl esters can hydrolyze or volatilize under certain conditions, so adequate fume scrubbing and closed transfer systems receive regular upgrades. Residual waste streams are neutralized before release, following both local and international best practices for fluorinated organics. Plant operators receive dedicated training and regular retraining to ensure that safety remains ingrained in routine operations.

    Risk identification never stops at the plant gate. Customers often inquire about product hazards, even with compounds considered to have moderate toxicity and environmental impact. By emphasizing clean, accurate labeling and real-time safety data sharing, we aim to build trust across the supply chain. This approach also helps receiving labs or handlers develop tailored safeguards appropriate to the specifics of the compound—protecting both personnel and end-products through informed practice, not generic warning labels.

    Future Outlook in Research and Application

    4-Fluorobutyric Acid Methyl Ester continues to find new life in emerging research. Recent years have seen it appear as a backbone component in target molecules designed for CNS research, and there is growing interest in its use for fluorinated biomolecule modification. As applications evolve, product requirements will become more exacting—demand for higher chiral purity, narrower impurity bands, and tighter documentation will follow.

    Ongoing investments in analytical capability and plant automation point to a future of even tighter process control, shorter lead times, and expanded technical support for those developing innovative uses. Our manufacturing team stays close to both customer feedback and broader industry developments, seeking to anticipate rising needs in specification, safety, and regulatory acceptance.

    Commitment Beyond the Batch

    Effective support begins with recognition that every customer order carries not just a shipment, but also a stake in that company’s next innovation, presentation, or product launch. Beyond technical compliance and inspection sheets, a manufacturer’s direct involvement with process, quality control, and open communication underpins long-term partnership. The experience gained with each batch feeds back into the production cycle, continuously improving outcomes for everyone relying on dependable 4-Fluorobutyric Acid Methyl Ester as a foundation for new success.