Tengfei Creation Center,55 Jiangjun Avenue, Jiangning District,Nanjing admin@sinochem-nanjing.com 3389378665@qq.com
Follow us:

4-Fluoro-2-Methylphenyl Isothiocyanate

    • Product Name 4-Fluoro-2-Methylphenyl Isothiocyanate
    • Alias 4-Fluoro-2-methylphenyl isothiocyanate
    • Einecs 707-578-0
    • 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

    512981

    Productname 4-Fluoro-2-Methylphenyl Isothiocyanate
    Casnumber 58690-95-0
    Molecularformula C8H6FNS
    Molecularweight 167.20
    Appearance Colorless to pale yellow liquid
    Boilingpoint 84-86°C at 12 mmHg
    Density 1.19 g/cm³
    Purity Typically ≥98%
    Solubility Soluble in common organic solvents
    Refractiveindex n20/D 1.582
    Smiles CC1=CC(=C(C=C1)F)N=C=S
    Synonyms 1-Isothiocyanato-4-fluoro-2-methylbenzene
    Storagetemperature Store at 2-8°C
    Hazardstatements Irritant; Harmful if inhaled or swallowed

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

    Packing & Storage
    Packing Amber glass bottle containing 10 grams of 4-Fluoro-2-Methylphenyl Isothiocyanate, securely sealed with a tamper-evident cap and labeled.
    Shipping 4-Fluoro-2-Methylphenyl Isothiocyanate is shipped in tightly sealed containers, protected from light and moisture. The chemical is classified as hazardous, requiring proper labeling and documentation. Shipping must comply with local and international regulations, including UN transport guidelines. Appropriate safety measures, such as secondary containment and cushioning, are ensured during transit.
    Storage 4-Fluoro-2-Methylphenyl Isothiocyanate should be stored in a tightly closed container in a cool, dry, and well-ventilated area, away from moisture, heat, and sources of ignition. Keep it away from incompatible materials such as strong acids, bases, and oxidizers. Store under inert gas if possible, and ensure proper labeling to prevent accidental exposure or misuse.
    Application of 4-Fluoro-2-Methylphenyl Isothiocyanate

    Applications of 4-Fluoro-2-Methylphenyl Isothiocyanate in Industrial Manufacturing

    4-Fluoro-2-Methylphenyl Isothiocyanate serves as a critical intermediate in specialist chemical synthesis across multiple advanced industrial sectors. Its isothiocyanate functionality and selective fluorine and methyl substitutions support complex molecule construction, especially in regulated manufacturing environments. Below, we detail main downstream uses and processing approaches proven by leading industry producers.

    1. Pharmaceutical Intermediate Synthesis

    Pharmaceutical manufacturers utilize this isothiocyanate for targeted thiourea and heterocycle formation during drug candidate research and production, particularly for fluorinated aromatics. It commonly integrates into multi-step process routes in small molecule development, facilitating the introduction of fluorophenyl isothiocyanate motifs essential for modulating bioactivity profiles in APIs and advanced intermediates. Process engineers optimize reaction parameters based on molecule-specific pathway design, ensuring batch purity and reaction completeness in line with regulatory expectations.

    Industry compliance standards

    • ICH Q7 GMP standards for API starting material handling
    • 21 CFR Part 211 (USA) for finished pharmaceuticals
    • Chinese Pharmacopoeia 2020 API impurity limits
    • EU GMP for active ingredient synthesis

    Typical usage ratio

    • 5–20 mol% relative to main scaffold substrate, adjusted by targeted yield and impurity envelope control

    Downstream process integration

    • Batch reaction step for isothiocyanation post-halogenation
    • Inline sampling for HPLC verification of conversion
    • Followed by quenching and isolation to secure intermediate purity

    Final product types

    • Custom active pharmaceutical ingredient intermediates
    • Targeted heterocyclic drug substances
    • Clinical candidate libraries with fluorinated phenyl cores

    2. Agrochemical Active Ingredient Manufacturing

    Key crop protection formulators adopt this compound for incorporation into advanced isothiocyanate-bearing agrochemical scaffolds. The building block brings unique molecular features supporting biological activity in specialty herbicide and fungicide R&D. Strict raw material traceability, batch reproducibility, and residue compliance must be observed, with close attention given to reaction throughput and downstream analytical controls to minimize off-target reactivity in the final molecule.

    Industry compliance standards

    • OECD GLP for agrochemical technical grade materials
    • FAO Specification for active substance purity
    • REACH Annex VII dossier requirements (EU)
    • China National Standard GB 2763 Maximum Residue Limits

    Typical usage ratio

    • 3–15 wt% in multi-component synthesis, regulated by target bioactive structure yield efficiency

    Downstream process integration

    • Isothiocyanate coupling in post-halogenation ring formation
    • Real-time solvent compatibility control to minimize hydrolysis
    • Residue assessment before final formulation batching

    Final product types

    • Select pre-emergent herbicides
    • Systemic fungicides with phenyl isothiocyanate linkage
    • Preparation of active ingredient concentrates

    3. Specialty Dye Intermediate Synthesis

    Fine chemical suppliers formulate specialty dyes by employing this isothiocyanate for thiourea bridge formation and dye molecule modification. Its structure enables tuned electronic effects in chromophore development, especially where solvent compatibility and lightfastness are critical. Each batch must comply with raw material purity protocols and color index standards. Tint strength and migration resistance drive the required process adaptation, especially for applications in plastics, fiber, and digital printing inks.

    Industry compliance standards

    • ISO 9001:2015 for quality assurance in dye manufacturing
    • Oeko-Tex Standard 100 for textile dye toxicity
    • European REACH SVHC compliance (Annex XVII)
    • EN 71-3 migration limits for toy safety pigments

    Typical usage ratio

    • 2–12 mol% in chromophore assembly, fine-tuned based on color depth and application end-use

    Downstream process integration

    • Introduction at thiourea functionalization stage
    • Coupling phase post core dye synthesis
    • Purification prior to dispersant addition

    Final product types

    • High-performance azo and anthraquinone dyes
    • Specialty organic pigments for technical plastics
    • Sublimation dyes for synthetic textile printing

    4. Advanced Polymer Modifier Production

    Polymer manufacturers integrate this chemical as a reactive monomer or modifier to introduce rigid aromatic units with defined functional groups into engineering plastics and coatings. Isothiocyanate reactivity allows for covalent linkage with nucleophilic co-monomers, affecting crosslink density and end-use mechanical or thermal properties. Real-time process control and finished polymer QC testing are necessary to stay within specified safety and performance bands.

    Industry compliance standards

    • ISO 14001 for environmental management during polymer processing
    • ASTM D638 for polymer tensile testing
    • FDA CFR 21.177.2600 (for indirect food contact polymers)
    • UL Yellow Card for flame retardancy assurance

    Typical usage ratio

    • 0.5–5 wt% as a reactive modifier in copolymer blend, adjusted per desired property enhancement and reactivity control

    Downstream process integration

    • Feed at reactive extrusion stage or bulk monomer mixing
    • Monitored copolymerization at elevated temperature
    • Online rheology checks and postpolymerization curing

    Final product types

    • High-performance plastics with improved rigidity
    • Specialty coatings for electronics and automotive components
    • Copolymers for medical device engineering

    5. Chemical Analytical Reagent Preparation

    Analytical laboratories and reference substance producers use this isothiocyanate as a specific derivatization agent for amine determination by LC-MS or HPLC analysis. The molecule helps enhance detection sensitivity by forming stable thiourea derivatives with primary and secondary amines for analytical calibration and product release testing. Each preparation batch requires stringent documentation for traceability as per laboratory accreditation.

    Industry compliance standards

    • ISO/IEC 17025 laboratory management
    • USP General Chapter <621> on chromatography
    • OECD Guidelines for the Testing of Chemicals
    • PAT (Process Analytical Technology) guidelines

    Typical usage ratio

    • 0.05–1 molar equivalent to analyte, optimized for sample concentration and detection limits

    Downstream process integration

    • Added post-sample preparation prior to injection
    • Reaction under controlled conditions for maximum derivative yield
    • Instrument calibration with reference thiourea products

    Final product types

    • Amine quantitation calibration kits
    • Analytical derivatization reagents
    • Finished quality control standard materials
    Free Quote

    Competitive 4-Fluoro-2-Methylphenyl Isothiocyanate prices that fit your budget—flexible terms and customized quotes for every order.

    For samples, pricing, or more information, please call us at +8615371019725 or mail to admin@sinochem-nanjing.com.

    We will respond to you as soon as possible.

    Tel: +8615371019725

    Email: admin@sinochem-nanjing.com

    Get Free Quote of Sinochem Nanjing Corporation

    Flexible payment, competitive price, premium service - Inquire now!

    Certification & Compliance
    More Introduction

    4-Fluoro-2-Methylphenyl Isothiocyanate: Staking Out Quality in Isothiocyanate Manufacturing

    An Inside Look at a Key Chemical Building Block

    We see a steady call for 4-Fluoro-2-Methylphenyl Isothiocyanate among developers in fields ranging from small-molecule synthesis to new material research. Our facility produces this isothiocyanate, known by its CAS number 55761-58-7, with careful attention paid to consistency and purity. By managing the full preparation from sourcing of 4-fluoro-2-methylphenyl precursors, to the final isothiocyanate conversion, lot after lot maintains a narrow impurity profile and reliable reactivity. Molecular weight sits at 167.18 g/mol. Liquid at room temperature, our process yields a clear to pale yellow fluid, handled and packaged in compliance with rigorous internal benchmarks, alongside established regulatory and export controls.

    How We Approach Synthesis and Quality Controls

    Working in-house from the level of aromatic substrate onward means process variables remain under our direct oversight. Typical isothiocyanate syntheses might struggle with batch-to-batch variations or tricky halogenation steps. Our team refined each stage. Adding methyl and fluoro substituents to the phenyl ring calls for clean temperatures, extended slow addition rates, and highly specific catalysts. Any departure can result in mixed halogenated byproducts or uncontrolled regioisomer content, complicating downstream chemistry.

    We monitor key markers in every production cycle—GC-MS and NMR analysis confirm that substitution is precise and that the –N=C=S group remains intact, while residual base and solvents drop below strict in-house cutoffs. Rigorous drying steps ensure low moisture, which matters in nucleophilic reactions or during storage in sensitive pharmaceutical environments. Our clients often push for minimized hydrocarbon impurities and no unidentified peaks, as traces of alternate regioisomers can undermine biological screens or polymer properties. By aiming for an assay of >98% (area normalization), without typical merchant shortcuts, we see positive reaction profiles in Suzuki and Sonogashira cross-coupling screening, as well as strong shelf life for inventory teams.

    Understanding the Role of the Fluorine and Methyl Groups

    Isothiocyanates represent an adaptable class. Adding a fluorine atom on the aromatic ring, especially in the para or ortho positions, changes its electronic properties. In our synthesis, the fluorine resides at the 4-position, and the methyl at the 2-position. The fluoro group tightens electron density, revealing reactivity patterns that conventional methyl- or unmodified isothiocyanates lack. It influences the electron cloud distribution, reducing side reactions and often increasing the performance of the target compound, such as in making covalent enzyme inhibitors.

    Chemists regularly draw on the balance of reactivity and selectivity that a 4-fluoro-2-methyl aryl isothiocyanate delivers. We have seen formulations benefit from the unique blend of electron-donating (methyl) and electron-withdrawing (fluorine) effects, fine-tuning both the rate and scope of downstream derivatizations, which include coupling to amines, thiols, or even click chemistry motifs. You won’t see those effects with plain phenyl isothiocyanate, which may react too broadly or degrade under heat and light. Methyl substitution at the ortho position can also alter substrate orientation, opening pathways for novel cyclizations or labeling reactions.

    Practical Applications: From Lab Scale to Commercial Synthesis

    Over the years, research programs reach out to us with questions not just about supply, but about how our 4-Fluoro-2-Methylphenyl Isothiocyanate behaves in real-world projects. In drug discovery, it features routinely in synthesis workflows where custom kinase inhibitors or targeted probes are designed. The specific substitution pattern lends stability in carbon–sulfur bond formation. The electrophilic –N=C=S group is especially reactive toward nucleophiles: with amines, it forms urea and thiourea frameworks; with thiols, it can offer direct linkage to bioconjugation handles.

    Material scientists come to us for cyclization strategies and new monomer designs. Our batches demonstrate strong reliability in ring-opening steps, and we hear from collaborators that the low trace metals profile avoids contamination in sensitive polymerizations. In the field of liquid crystal development, the 4-fluoro substituent gives predictable mesophase behavior when built into aromatic cores—regularly a sticking point when uncontrolled isomer formation from generic suppliers clouds the outcome.

    Beyond R&D, we see increasing requests for kilogram-scale material with reproducible shelf stability. By using clean glass and polymer lines and filling only after quality controls sign off, our product reaches both academic labs and large pharmaceutical platforms. Packaged under nitrogen and in amber bottles or steel vessels, it resists hydrolysis and photo-degradation more effectively than outdated packaging standards. Clients often report the absence of erratic yellowing and sedimentation, reflecting the care we take at every stage.

    Addressing Supply Chain Integrity and Traceability

    Trust in source and lot-tracking underpins both regulatory requirements and peace of mind for every chemist who orders from us. We assign every vessel, drum, and bottle a unique lot code, providing a complete chain of paperwork—from raw material to final QC. Traceability helps solve future analytical issues or root out anomalies if analytical signatures ever shift. Laboratories operating under GLP or GMP ideals expect this level of transparency, and our own audits regularly review data for completeness.

    Requests for documentation frequently extend to detailed impurity reports and stability data. Since we manufacture the starting 4-fluoro-2-methylaniline, every precursor’s profile gets archived, and we make the data available to partners on request. Control at this level strengthens programs seeking regulatory submissions, patent defense, or consistent results in sensitive biological screens. We have seen others rerun screens due to variable supply, and we strive to shield our collaborators from these setbacks.

    How We Compare: Distinguishing Ourselves from Commodity Alternatives

    Manufacturers often promote “4-Fluoro-2-Methylphenyl Isothiocyanate” but purchase core intermediates or packaged stock from bulk traders, losing touch with underlying quality. Every handful of months, samples reach us from groups frustrated by inconsistent melting points, odd odors, or drifting NMR signals. More than once, we have mapped spurious IR bands to residual acid chlorides, or isolated decaying material that began to polymerize due to improper stabilizer dosing. By maintaining in-house syntheses, our output stays tightly controlled. Customers find batches match the COA—we do not source externally and relabel.

    Commodity supplies may cut costs at the steps of halogenation, omit full chromatography, or forego inert packaging. These shortcuts produce a gray zone around identity and purity. Downstream, even a percent or two of mixed isomers can derail medicinal chemistry timelines or cause revalidation work. When screening new drug candidates, teams rely on certainty in starting material integrity. Every impurity scavenged out of our lots means fewer headaches after scale-up, lower risk of domino-effect purification costs, and faster regulatory clearance.

    Feedback from current partners underscores these points. Those who move from spot purchases or third-party sources emphasize the drop in rework rates and clearer analytical profiles. Custom pack sizes, tailored drying or specific stabilizer addition are possible. We know that each research program thinks several steps ahead, so rather than standardizing for average usage, we open lines for direct technical input. Developers looking to troubleshoot reaction failures, or isolate elusive intermediates, tap in to our real-time support—not just from account managers, but actual bench chemists who work with these molecules daily.

    Safety as a Foundation, Not an Afterthought

    Isothiocyanates need careful handling due to their high reactivity. Our facility deploys strict ventilation, personal protection, and leak monitoring. Every technician, from production to packing, gets targeted training not just for hazard management, but for understanding the molecular behavior of what we produce. Fume hoods, specialized seals, and rapid spill response are basics—yet consistent long-term staff retention means deeper know-how and discipline.

    Distribution routines include secondary containment, independent auditing of packaging stability, and rapid response protocols if transit irregularities are flagged. Temperature swings, light exposure, and accidental venting all risk product degradation. By directly handling global shipments from our temperature-controlled warehouse, supply interruptions and product compromise are minimized, and replacement plans activate fast if required. We supply clear user guides not as a box-ticking exercise, but as a complement to real-world technical troubleshooting.

    Hazard labeling, REACH and TSCA certificates, and dual-use permits are always kept up to date, with digital and print copies available to end users upon request. Our safety data comes not only from literature, but from long-standing experience from pilot plant to ton-scale orders. Health and safety form the lens through which we assess every new project.

    Potential Hurdles: Logistical and Market Pressures

    Recent volatility in halogenated aromatic markets, in parallel with interruptions in freight traffic (especially east-Asian port delays and regional raw material embargoes), can challenge reliable sourcing for specialty chemicals. While some end users treat such problems as an unavoidable part of the sector, we counteract these disruptions by securing direct supply agreements and by maintaining backup stocks of core intermediates across separate storage facilities. Before a shortage hits, our logistics team will have adjusted procurement actions to smooth out future waves of demand.

    Tariffs, hazardous material surcharges, and evolving environmental legislation pose hurdles. Each raw material, especially fluorinated aromatics, faces scrutiny from both commodity market actors and regulators. Rather than standing still, we move to qualify renewable or lower-impact production lines. Each new customer inquiry updates our sense of market timing and raw material flow—rather than holding everyone up with rigid forecasting, we maintain open dialogs with industry partners.

    Responsiveness to Technical Challenges

    Research does not stop at textbook reactions. Often, partners find standard isothiocyanate protocols falter: perhaps a new fluorophore coupling needs lower temperatures, or complex peptide conjugation demands ultra-sharp purity cuts that bulk isothiocyanates cannot match. We work side by side with clients, revising production or purification until their analytical signals clear up. Options for recrystallization, double distillation, or specialized stabilizer dosing flow from ongoing feedback, not simply from a one-off launch.

    Working directly at the manufacturing bench, our chemists document every technical hiccup. Should a batch show unexpected color drift or foaming tendencies, data goes to process improvement rounds. Partnerships with university departments and industrial R&D groups provide fresh insight, which in turn tightens our analytical approach. We believe keeping doors open for tailored modifications and encouraging real-time reporting—not just catalog sales—brings better outcomes for discovery timelines.

    Final Thoughts: Reliable Chemistry, Experienced Hands

    Our manufacturing team covers the full cycle, from planning runs and sourcing intermediates, to analytical certifying, storage, and shipping. This includes pushing for the cleanest, most consistent 4-Fluoro-2-Methylphenyl Isothiocyanate available. What sets us apart? Control, transparency, and a readiness to fine-tune batches for research that rarely fits a template. We see first-hand that cross-talk between bench chemists and process managers replaces delays and confusion with order, safety, and new possibility.

    Demand for this isothiocyanate signals a shift toward specialty function in aromatic chemistry. By blending scientific rigor and common sense supply practices, we help teams focus on their goals rather than on the background noise of rework, red tape, and uncertainty. As more groups look for assured quality, tailored delivery, and hands-on technical support, we keep laying the groundwork for long-term partnerships on both sides of the development pipeline.

    Why Our Approach Matters

    We believe quality never happens by accident. Each bottle of 4-Fluoro-2-Methylphenyl Isothiocyanate reflects a long chain of hands-on work, process discipline, and close listening to real user challenges. Whether building next-generation synthons, supporting sensitive analytical work, or pushing boundaries in chemical biology, our team exists to make sure each project has solid ground to build on—batch after batch, year after year.