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4-Methyl-2-Nitrophenyl Isothiocyanate

    • Product Name 4-Methyl-2-Nitrophenyl Isothiocyanate
    • Alias MNIT
    • Einecs 619-801-9
    • 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

    947934

    Chemicalname 4-Methyl-2-Nitrophenyl Isothiocyanate
    Casnumber 15055-89-9
    Molecularformula C8H6N2O2S
    Molecularweight 194.21
    Appearance Yellow crystalline solid
    Meltingpoint 77-79°C
    Solubility Slightly soluble in organic solvents
    Purity Typically ≥98%
    Storage Store at 2-8°C, protect from light
    Synonyms 4-Methyl-2-nitrophenylisothiocyanate
    Smiles Cc1ccc(N=C=S)c([N+](=O)[O-])c1
    Inchi InChI=1S/C8H6N2O2S/c1-6-2-3-7(9-5-13)8(4-6)10(11)12/h2-4H,1H3

    As an accredited 4-Methyl-2-Nitrophenyl 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 labeled "4-Methyl-2-Nitrophenyl Isothiocyanate, 5 grams," with hazard symbols, lot number, and supplier information.
    Shipping 4-Methyl-2-Nitrophenyl Isothiocyanate is shipped in tightly sealed containers, protected from light, moisture, and incompatible substances. It should be labeled as a hazardous chemical, handled with appropriate safety precautions, and typically shipped via ground or regulated air freight in accordance with local, national, and international chemical transportation regulations.
    Storage 4-Methyl-2-Nitrophenyl Isothiocyanate should be stored in a tightly closed container, in a cool, dry, and well-ventilated area, away from moisture, heat, and direct sunlight. Keep separate from incompatible substances such as strong acids, bases, and oxidizing agents. Store under inert atmosphere if possible. Always handle with protective equipment to prevent inhalation, skin, and eye contact.
    Application of 4-Methyl-2-Nitrophenyl Isothiocyanate

    Applications of 4-Methyl-2-Nitrophenyl Isothiocyanate in Industrial Manufacturing

    4-Methyl-2-Nitrophenyl Isothiocyanate serves as a specialized intermediate in a narrow set of chemical manufacturing fields. Its performance characteristics support specific reactions in advanced organic synthesis, functional dye production, pharmaceutical research, and peptide modification. The following sections detail real-world downstream scenarios supported by industry standards, precise dosage guidelines, established integration steps, and delivered final products.

    1. Peptide Sequencing Reagent for Analytical Laboratories

    This compound acts as a derivatization reagent for Edman degradation sequencing of peptides and proteins within analytical laboratories that require high specificity for N-terminal identification. Its use improves the selectivity of cleavage and labeling within automated peptide synthesis workflows, particularly for research and quality control in bioanalytical applications. Lab technicians rely on the compound's high reactivity to generate stable derivatives compatible with chromatographic detection.

    Industry compliance standards

    • ISO 17025 Laboratory Accreditation
    • Good Laboratory Practice (GLP)
    • ICH Q2(R2) for analytical method validation
    • USP <1225> Validation of Compendial Procedures

    Typical usage ratio

    • 0.1–0.4 mmol per mmol peptide substrate (stoichiometric to slight excess based on peptide concentration and method sensitivity)

    Downstream process integration

    • Added during the N-terminal derivatization step as part of the Edman degradation reaction cycle prior to PTH-amino acid extraction and identification

    Final product types

    • PTH-amino acid derivatives for HPLC or LC-MS analysis
    • Sequenced peptide maps for protein characterization studies

    2. Intermediate in the Synthesis of Specialty Azo Dyes

    4-Methyl-2-Nitrophenyl Isothiocyanate is directly incorporated into the diazotization and coupling stages to introduce isothiocyanate functional groups into azo dyes. Textile and ink producers value these functionalities for enhanced fabric binding and dyefastness properties. The compound allows precise molecular tuning in dye design for applications demanding high resistance to washing and light exposure, particularly in technical fabrics.

    Industry compliance standards

    • OEKO-TEX® Standard 100
    • ZDHC MRSL (Zero Discharge of Hazardous Chemicals Manufacturing Restricted Substances List)
    • EN ISO 105-C06 for color fastness testing
    • REACH Regulation (EC) No 1907/2006

    Typical usage ratio

    • 2–7% by weight relative to the aromatic amine substrate (determined by target dye structure and process yield requirements)

    Downstream process integration

    • Participates in the coupling step after diazotization, controlling insertion of isothiocyanate moieties before sulfonation and standardization stages of dye production

    Final product types

    • Reactive azo dyes for cellulosic fiber dyeing
    • Technical inks for inkjet and screen-print applications

    3. Key Structure Agent in Pharmaceutical Intermediate Manufacturing

    As a core building block, this material is used in the assembly of complex heterocyclic pharmaceutical intermediates, integrating into substitution and cyclization steps to produce active APIs and validated drug intermediates for later-scale-up. Medicinal chemistry teams apply it to generate isothiocyanate-containing scaffolds that underpin kinase inhibitors, peptide mimetics, and other investigational small molecules. Its quality consistency is crucial for route reproducibility and data traceability during scale-up.

    Industry compliance standards

    • ICH Q7 Good Manufacturing Practice for Active Pharmaceutical Ingredients
    • 21 CFR Part 211 (cGMP for Finished Pharmaceuticals)
    • EDQM Certification of Suitability (CEP) process
    • USP-NF monograph guidance for API intermediates

    Typical usage ratio

    • 1.2–1.5 equivalents relative to the nucleophilic coupling partner in small molecule synthesis (scaled per batch size and route of synthesis)

    Downstream process integration

    • Fed into nucleophilic aromatic substitution, followed by thermal cyclization and protective group removal in multi-step synthesis workflows

    Final product types

    • Pharmaceutical intermediate solids
    • Advanced isothiocyanate motif drugs
    • Reference standards for pharmaceutical R&D

    4. Covalent Labeling Agent for Custom Peptide/Protein Modification

    The compound’s selective isothiocyanate group targets primary amines, making it effective in amino group functionalization in specialized custom peptide modification lines. Bioconjugation experts use it to add UV-absorbing or colored tags to peptides, supporting downstream process needs in immunoassay kit development, molecular probe synthesis, and cell labeling reagents. Manufacturers demand ultra-pure grades to secure reproducibility in analytical and diagnostic device production.

    Industry compliance standards

    • ISO 13485 Medical Devices Quality Management
    • Good Manufacturing Practice (GMP, EU Annex 1 for Diagnostic Reagents)
    • FDA 21 CFR Part 820 (Quality System Regulation for In Vitro Diagnostic Products)
    • IFCC Guidelines (International Federation of Clinical Chemistry)

    Typical usage ratio

    • 0.3–1.0 molar equivalents per amino group (optimized based on protein/peptide length and desired labeling density)

    Downstream process integration

    • Introduced during selective conjugation reactions post-synthesis, before purification and formulation into diagnostic reagent batches

    Final product types

    • Immunoassay calibration standards
    • Labeled protein/peptide diagnostics
    • Molecular tags for bioanalytical assays

    5. Research Tool for Nitroarene-Based Organic Synthesis

    Synthetic chemists integrate 4-Methyl-2-Nitrophenyl Isothiocyanate in the assembly of advanced nitroarene scaffolds for reference compound synthesis and polymer chemistry research. The reagent introduces both nitro and isothiocyanate groups in stepwise reactions, helping researchers generate new chemical entities and functional monomers. Pilot facilities and R&D centers value batch-to-batch reproducibility and high assay grade to ensure reliable exploratory syntheses for patent submission and new material evaluation.

    Industry compliance standards

    • ISO 9001:2015 (Quality Management System for R&D Chemicals)
    • OECD Principles of Good Laboratory Practice
    • Company-internal standard operating procedures (SOPs) for custom molecule synthesis
    • Patent application technical dossier requirements

    Typical usage ratio

    • 1.0–3.0 equivalents relative to the aromatic or heterocyclic nucleophile, adjusted according to the reaction’s exploratory objectives

    Downstream process integration

    • Charged into functionalization reactions post-nitration or during iterative substitution steps for scaffold diversification

    Final product types

    • Reference compounds for analytical validation
    • Prototypic nitroarene monomers
    • Small-scale specialty resins for advanced materials research
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    Certification & Compliance
    More Introduction

    4-Methyl-2-Nitrophenyl Isothiocyanate: A Chemist’s Approach from the Factory Floor

    Introduction to 4-Methyl-2-Nitrophenyl Isothiocyanate

    Over the years in our facility, we have poured much thought and sweat into refining our process for manufacturing 4-Methyl-2-Nitrophenyl Isothiocyanate (CAS 21348-13-6). This compound, with the model MPC-413, stands out for a reason—building specialty isothiocyanates stretches far beyond mere batch repetition. The actual work lies in the details: carefully controlling the nitro and methyl group substitution, keeping process streams clean, and minimizing side-product formation so that research and industry professionals receive exactly what their projects demand.

    Our Approach to Manufacturing: Lessons from Practice

    Every day in chemical production puts quality claims to the test. For 4-Methyl-2-Nitrophenyl Isothiocyanate, synthesis means more than a string of reactions. Our teams have tapped direct experience to improve each step. Starting from the selection of methylated nitroanilines, we map out potential process impurities. We routinely use HPLC and NMR analysis after every batch, not because some guidebook says so, but because deviations—no matter how small—show up right away in the downstream results for our end-users. We have learned that simple filtration is rarely enough; purification takes more than one pass. Every small tweak over the years—extra drying stage, temperature control, and impurities profiling—has paid off in the stability and purity levels that researchers mention in their feedback.

    Peculiarities of 4-Methyl-2-Nitrophenyl Isothiocyanate

    The structure of this compound fits synthetic and analytical chemistry well. The isothiocyanate moiety lends itself to straightforward coupling reactions. It isn’t just about achieving a yield on paper. In production, we find even minor water ingress in the process stream leads to hydrolysis risks, and trace acid residues from earlier nitrosation steps can trigger side reactions. Our approach involves three moisture checks and specialized in-line scrubbers to hold spec all the way to final packaging. These small steps stand between our product and the unpredictability that can ruin an otherwise good experiment.

    Not all isothiocyanates behave the same way in use or storage. Some degrade into sticky residues far too fast. With 4-Methyl-2-Nitrophenyl Isothiocyanate, handling under inert gas and careful selection of glass over plastic during bottling avoid trace contamination. Iron and copper catalyze decomposition, so only inert materials see the product inside the plant. These choices come right out of years battling unexplained color changes and purity drifting off spec.

    Specifications: More Than a List of Numbers

    Purity requirements aren’t just numbers to hit. The daily pressure to keep our typical minimum purity above 98.5%—and to avoid letting off-odor batches slip through—poses constant production challenges. Batch consistency beats high scores on occasional runs. Every time we adjust process temperature or aging period, we gauge its effect on not only purity, but also stability, handling safety, and shelf-life. Analytical checks follow the sample from synthesis to finished lot, but it’s the constant documentation and repeat runs that expose the tiniest fault lines—unseen water ingress or micro-impurities from packaging.

    Physical form matters too. On the line, sticking and clumping affect end-user ease far more than they do in a data sheet. This is why we use milling or granulation steps only after the compound passes several stability challenges, not before. Only after batch after batch survives shipping trials without caking or decomposition do we lock in a form. This saves customers frustration, and reveals itself most clearly not in warehouse inventory, but in the praised shelf stability labs notice after months of storage.

    Applications: Insights from Users and Plant Knowledge

    In our direct conversations with laboratories and small manufacturers, we hear requests shaped by trial and error at their benches, not ideas from the back of a brochure. They count on 4-Methyl-2-Nitrophenyl Isothiocyanate for its consistent reactivity in peptide synthesis, specifically in solid-phase routes and analytical derivatization. The defense against side-reactions, which torpedoes yields and wastes high-value substrates, always begins with the raw material’s purity. Research teams running LCMS or HPLC know that trace impurities, even below the 1% mark, catalyze unexpected peaks and background noise. These realities have shaped how we run the plant. Most direct users prefer a package size that matches single-run batch sizes—so we keep small-scale lots fresh and avoid bulk handling whenever possible.

    This isothiocyanate outperforms standard phenyl variants in environments that demand clear analytical signals. The extra methyl group slightly changes polarity and solubility, which has tangible effects in chromatographic prep and clean peptide hydrolysis. In QC tests, we’ve seen detection signals come through sharper, and less non-specific reactivity—for researchers running complex assays, this can make their day. Feedback cycles with our major partners proved that a single lot of out-of-spec product sets back weeks of screening in peptide and pharmaceutical synthesis. That risk keeps us strict at every stage, no matter how routine the run.

    Comparing to Other Isothiocyanates: Not All Are Equal

    Over two decades, we have worked with a spectrum of isothiocyanates. The direct comparison with more basic phenyl or substituted phenyl analogues shows distinctions that echo through both our process and the research benches of our customers. Not all substitutions change reactivity the same way; the 4-methyl and 2-nitro groups on the aromatic ring change electron distribution, which in practice fine-tunes reactivity and selectivity in peptide derivatization. Our QA team saw that the 2-nitro group slows some hydrolysis side reactions, leading to longer working times during coupling steps—giving researchers more room to control their syntheses.

    On the plant floor, not all isothiocyanates smell, flow, or store the same. The extra methyl group in our product changes melting point and handling characteristics. While simple phenyl isothiocyanate can quickly build up residues on process lines, our experience shows 4-Methyl-2-Nitrophenyl Isothiocyanate requires less line cleaning after batch runs. Lost yield from sticking to equipment used to dog our earlier processes; with this compound, downtime for cleaning drops noticeably.

    Users aiming for high-throughput synthesis often share with us that the ease of handling, lower volatility, and reduced odor create a safer and more pleasant work routine. Some isothiocyanates have such strong odors and high volatility that handling outside a fume hood feels risky. Our plant’s improvement in refining off-odors has come from consistent headspace GC analysis—far beyond standard requirements—so researchers are not handed an unavoidable nuisance or safety concern.

    Packaging and Delivery: Addressing Real-World Challenges

    On our end, packaging is more than a final step. Experience has shown that even the best product can degrade through tiny lapses in sealing. Exposure to air or traces of acid during filling changes the outcome on the user’s end in a way no specification sheet will mention. We keep filling lines separate for moisture-sensitive chemicals, and regularly inert lines with dry nitrogen. Every lot is packed in containers selected for their inertness—glass, free from surface residues, and cleaned via validated detergent and rinse protocols. Those years of nagging issues with discoloration in storage are now behind us thanks to these steps.

    We learned early on that delivery schedules can break a lab’s schedule. That lesson pushed us to work tightly with shipping partners, track climate and storage conditions during transit, and double-wrap every primary container. For export clients, who often need to hold stock on site, shelf-life holds up due to these control measures. Labs return for repeat orders because the product looks and works the same, shipment after shipment. Reliability breeds more trust than any claim we can make on a website.

    Regulatory and Environmental Awareness from a Production Perspective

    Handling nitro- and isothiocyanate-based compounds means special care toward regulatory compliance, both for the health and safety of our employees and the community around our facility. Each run involves real-time monitoring for emissions and regular audit cycles. Our work with environmental engineers ensures emissions stay well below regulatory thresholds. We continually invest in effluent purification rather than gamble on end-of-pipe fixes. Waste treatment and air filtration, though invisible in the final product, help sustain both our license and our team’s reputation with neighbors.

    Frequent regulatory updates call for a plant’s technical and documentation teams to stay fully informed. Each batch gets traceability documentation going back to raw materials, and we log every change to process conditions as part of GMP protocols. No detail stays off the books. Our site reviews incident logs every week to train new staff and keep small-scale deviations from turning into major compliance problems.

    Challenges and Opportunities in Production and R&D

    Running a plant that produces 4-Methyl-2-Nitrophenyl Isothiocyanate means wrestling with constant challenges. Process upsets, unpredictable raw material quality, and even weather shifts teach us to double-check the little things. One autumn, humidity spikes led to a rash of off-color product despite unchanged process parameters. Relentless tracking and on-the-spot troubleshooting solved that issue—but more importantly, it taught us to install better dehumidification and pre-screen incoming chemicals.

    Another challenge stems from sourcing intermediates. Market shifts in aromatic amine availability can slow production or increase impurity loads. We respond by working hands-on with suppliers, reviewing their QA data through lab visits, and holding new raw material batches to the same tight standards as finished product. No surprise that small investment in supplier relationships pays off in unforeseen ways—lower downtime, better troubleshooting support, and more honest communication.

    On a positive front, years spent perfecting this compound’s synthesis have led to unexpected discoveries. Insights gleaned from impurity profiling have let our R&D team offshoot into adjacent compounds, some of which have gone on to become valuable in other research applications. Direct feedback from research partners gives our process engineers the grounding to keep innovating new tweaks—whether for better purification, energy efficiency, or greener reaction pathways.

    Practical Advice for Researchers and Industrial Users

    From our vantage point, repeat success with 4-Methyl-2-Nitrophenyl Isothiocyanate comes from a mix of preparation and careful handling. Small details—using the right pipette tips, storing away from direct sunlight, minimizing exposure to acidic vapors—add up to big improvements in the lab or pilot plant yield. Opening a fresh container only when ready to use, discarding partial volumes, and maintaining logs of every run lets researchers trace issues back to their root. Through hundreds of customer support calls, we have found that nearly all performance complaints vanish once users shift to more careful handling and storage.

    In peptide synthesis, benefits show up in better coupling yields and more reliable analytical performance. Simple fluorous or solid-phase extractions work better, and the product’s consistent handling behavior saves time at the bench. Technical staff in analytical labs often report that, among all tested isothiocyanates, this specific variant best avoids ghost peaks in HPLC analysis. This consistency, sharply improved by strict in-plant controls, proves more valuable in real projects than any theoretical claims about reactivity.

    Continuous Improvement and Listening to Feedback

    No plant process ever stays perfect. New issues arise as users probe the compound’s limits, and not every run works as well as projected on paper. We keep fielding ideas and concerns from customers, colleagues, and technical reviewers. One research group flagged rare instability in ultra-high-temperature reactions—a case we wouldn’t have discovered in-house. We mapped out new process controls and offered tailored risk communication so those rare use cases can get informed choices, not false assurances.

    Regular customer audits keep us honest. Watching researchers load up their automated synthesizers, seeing firsthand the impact of even slight off-spec batches, and learning from their troubleshooting routines give us a direct line from the factory floor to the research bench. By looping these lessons back into internal training and process tweaks, we make sure product quality slowly ratchets upward.

    The Value in Doing Things Right: A Manufacturer’s Reflection

    Managing a process for specialty isothiocyanates such as 4-Methyl-2-Nitrophenyl Isothiocyanate means more than maintaining a run of clean batches. It means recognizing—through hard-earned experience—that small flaws ripple out, sometimes weeks after shipping, and that attention to fundamentals pays off. Direct feedback, transparent issue tracking, methodical documentation, and close relationships along the supply chain all combine to sustain reliability.

    Everyone involved—from plant operators managing critical reaction stages, to QA staff painstakingly checking each batch, to logistics coordinators keeping things stable in shipment—knows their work reverberates through research results worldwide. Our motivation stands clear every time a customer thanks us for a smooth-running synthesis, a clear HPLC trace, or a batch that keeps stability nine months down the line without a hiccup.

    Looking Ahead: Embracing Change and Sustaining Trust

    Future production will bring its share of new challenges: tighter environmental standards, shifts in global logistics, and the push for lower-waste, energy-conscious synthesis. In-plant innovation—new catalysts, reclaimed solvents, and digital monitoring—will shape the next generation of specialty isothiocyanates. We stay committed to sharing what we learn, keeping communication open, and treating every project as another chance to improve. Every improvement, no matter how incremental, shows up as trust from researchers and success in their results.

    Feedback, challenge, and the push for continual progress drive us onward. That persistent sense of responsibility keeps us alert and accountable—not just to our QA checklists, but to the working scientists and chemical engineers relying on the quality of our 4-Methyl-2-Nitrophenyl Isothiocyanate, batch after batch, year after year.