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2-Bromo-4-Methylphenyl Isothiocyanate

    • Product Name 2-Bromo-4-Methylphenyl Isothiocyanate
    • Alias 2-Bromo-4-methylphenyl isothiocyanate
    • Einecs 841-496-0
    • 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

    228018

    Chemicalname 2-Bromo-4-Methylphenyl Isothiocyanate
    Casnumber 101554-23-0
    Molecularformula C8H6BrNS
    Molecularweight 228.11 g/mol
    Appearance Yellow to brown solid
    Meltingpoint 48-52 °C
    Purity Typically ≥97%
    Solubility Soluble in organic solvents (e.g., dichloromethane, chloroform)
    Storageconditions Store in a cool, dry place; keep container tightly closed
    Smiles CC1=CC=C(C(=C1)Br)N=C=S
    Inchikey JVXYSULBFZTKHZ-UHFFFAOYSA-N

    As an accredited 2-Bromo-4-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 with secure screw cap, labeled "2-Bromo-4-Methylphenyl Isothiocyanate, 10g," displaying hazard symbols and handling instructions.
    Shipping 2-Bromo-4-Methylphenyl Isothiocyanate is shipped in tightly sealed containers, protected from light, moisture, and heat. It is classified as a hazardous material and must be packaged according to regulations. Proper labeling and documentation are required, and transport is typically via ground or air with restricted access to authorized personnel only.
    Storage 2-Bromo-4-Methylphenyl Isothiocyanate should be stored in a tightly sealed container, in a cool, dry, and well-ventilated area, away from direct sunlight and sources of ignition. Keep away from moisture, acids, and incompatible materials. Store under inert atmosphere if possible to prevent decomposition. Always follow appropriate chemical safety protocols and label containers clearly.
    Application of 2-Bromo-4-Methylphenyl Isothiocyanate

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

    Our production of 2-Bromo-4-Methylphenyl Isothiocyanate supports specialized synthesis workflows across advanced material and pharmaceutical sectors. Below, we detail established downstream applications that integrate this raw material into defined industrial processes, with a focus on compliance, formulation, process specifics, and end uses recognized by manufacturers worldwide.

    1. Pharmaceutical Intermediate for Targeted Kinase Inhibitors

    This compound acts as a valuable isothiocyanate intermediate in the multi-step synthesis of small molecule kinase inhibitors used in modern oncology drugs. Researchers incorporate it during the construction of core pharmacophores requiring high regioselective substitution, essential for next-generation cancer treatment development. Drug master files incorporate analytical traceability for this intermediate, and its use requires precise monitoring throughout process validation in pharmaceutical manufacturing.

    Industry compliance standards

    • cGMP (ICH Q7, FDA 21 CFR Part 211)
    • USP General Chapter <1072> for impurities
    • EDQM CEP as applicable
    • EudraLex Volume 4 (EU GMP Guidelines)

    Typical usage ratio

    • 0.3–1.2 molar equivalents in targeted reaction steps; adjusted according to target molecule complexity and batch scale

    Downstream process integration

    • Added during early to mid-stage heterocyclic ring-forming reactions
    • Integrated pre-crystallization for impurity removal
    • Monitored by in-process HPLC/GC analysis during coupling or substitution stages

    Final product types

    • Active pharmaceutical ingredients (API) for targeted oncology drugs
    • Reference standards for kinase inhibitor research
    • Investigational small molecule compounds

    2. Agrochemical Intermediate for Novel Fungicides

    Downstream agrochemical producers utilize this isothiocyanate as a key building block in the development of aryl-thiourea moieties present in new fungicidal actives. It enables specific thio-substitution pathways within multi-step synthetic routes, supporting formulators in meeting stringent regulatory and efficacy demands for modern crop protection solutions. The compound’s high purity minimizes batch variability and satisfies trace-level impurity thresholds required by regulatory agencies.

    Industry compliance standards

    • OECD GLP principles
    • FAO/WHO Joint Meeting on Pesticide Specifications (JMPS)
    • REACH Annex VII (EC 1907/2006)
    • ISO 17025 certified laboratory analysis

    Typical usage ratio

    • 1.0 molar equivalent for core coupling steps; variations for pilot vs. industrial scale based on target yield and reaction efficiency

    Downstream process integration

    • Combined with amines in the synthesis of aryl-thioureas
    • Utilized in mid-stream isolation-purification to ensure high activity in finished actives
    • Incorporated as an intermediate, monitored for residual elimination before formulation

    Final product types

    • Fungicidal active ingredients for cereal and vegetable protection
    • Pre-formulated bulk technical materials
    • Test standards for regulatory submission and environmental fate studies

    3. Fine Chemical Synthesis for Organic Materials R&D

    Chemical laboratories and pilot facilities employ this material to introduce uniquely functionalized aryl isothiocyanate motifs into target molecules, driving new developments in organic electronics and specialty polymers. It allows access to rare functional groups in laboratory-controlled small-series syntheses where structure-activity relationships are studied under rigorous analytical methods, directed by proprietary research protocols and material safety assessments.

    Industry compliance standards

    • ISO 9001:2015 for QC documentation
    • Internal R&D handling SOPs
    • GHS/CLP labeling and SDS compliance (EC 1272/2008)
    • Institutional chemical management policies (e.g., NIH/OSHA)

    Typical usage ratio

    • Variable: 0.1–2.0 equivalents depending on target molecule and research scale; determined by structure-targeted stoichiometry

    Downstream process integration

    • Initial reagent in nucleophilic substitution or cyclization pathways
    • Controlled addition in air-free glovebox or low-moisture batch reactors
    • Integration monitored by NMR, LC-MS in material verification steps

    Final product types

    • Functionalized building blocks for OLED precursor studies
    • Specialty aryl-thiourea monomers for polymer science
    • Custom organic compounds for patent-pending application trials

    4. Intermediate in Dye and Colorant Manufacture

    Colorant manufacturers incorporate this compound as an aryl isothiocyanate source to create precursors for sulfur-containing azo and thioindigo dye classes. It reacts selectively in condensation steps critical for chromophore functionality, supporting controlled batch synthesis while meeting occupational safety and chemical registration requirements. Formulators adjust input based on shade intensity and performance specifications for finished dyes destined for textile and plastic applications.

    Industry compliance standards

    • REACH chemical registration (EC 1907/2006)
    • OEKO-TEX product class specifications
    • ZDHC MRSL compliance
    • Toy and textile product safety directives (EN 71-3, CPSIA)

    Typical usage ratio

    • 0.8–1.5 molar equivalents, depending on batch scale and target color strength

    Downstream process integration

    • Fed into aryl-thiourea synthesis under controlled temperature conditions
    • Employed in post-condensation purification by column or crystallization
    • Quality-checked via UV-Vis and shade consistency tests before isolation

    Final product types

    • Thioindigo dye intermediates for PET and polyamide textiles
    • Sulfur-containing azo dye precursors for plastics
    • Bulk colorant materials for pigment paste formulation

    5. Active Agent Precursor in Chemical Sensor Materials

    This compound serves as a core reactant for syntheses of aryl isothiocyanate-based ligands, contributing to the development of molecular sensors for heavy metal detection and environmental analysis. Downstream processors apply this compound in the production of selective coordination complexes embedded in sensing films, ensuring strict documentation for environmental application approvals and calibrating input for functional response based on laboratory efficacy data.

    Industry compliance standards

    • ISO 13485 (for sensor assembly if biomedical)
    • RoHS and WEEE environmental directives
    • ASTM D1193 (for reagent water in analytical processes)
    • Documentation per EPA Method 200.7/200.8 for sensor validation

    Typical usage ratio

    • 0.5–1.1 equivalents, tuned to ligand loading and polymer support batch scale

    Downstream process integration

    • Reacted with diamine ligands to form chelating structures in one-pot syntheses
    • Deposited onto sensor substrate or polymer film during immobilization
    • Residual monitoring via spectroscopic assay before device sealing

    Final product types

    • Heavy metal selective sensor modules
    • Water-quality testing strips
    • Field-deployable chemical sensor kits
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    Certification & Compliance
    More Introduction

    2-Bromo-4-Methylphenyl Isothiocyanate: Our Perspective from the Factory Floor

    The Story Behind the Chemistry

    In our line of business, we listen more to the demands of the lab bench than to buzzwords from a boardroom. Making 2-Bromo-4-Methylphenyl Isothiocyanate is not about ticking boxes for an inventory. It is a process that builds on practical experience and patience with details. We work under fume hoods, checking crystal clarity and odor, not just purity percentages on a sheet. Chemistry rewards precision, and this compound serves as proof of what focused synthetic effort achieves.

    Our plant evolved over years as specialty requests from pharmaceutical clients led us to perfect the preparation of isothiocyanates. Among the many aromatic compounds we manufacture, 2-Bromo-4-Methylphenyl Isothiocyanate stands out. This molecule brings together a bromine atom and a methyl group in the right orientation on a phenyl ring, then attaches the reactive isothiocyanate group in a straightforward but demanding synthesis. It is not so common to find this combination supplied at reliable quality in Asian or Western markets, let alone by manufacturers who run strict in-house analytical checks throughout production.

    Model, Appearance, and Consistency That Matter in Real World Synthesis

    Chemists who place orders with us always ask about material integrity. We focus on substance, not packaging. The product usually appears as a pale yellow to off-white crystalline solid, sometimes with a faint musty scent from the isothiocyanate. Consistency matters. If the color deepens or the crystals look clumpy, we stop the batch until it passes checks for purity, verified by both HPLC and NMR.

    We developed a go-to lot that fits most demanding work. Typical specifications include purity above 98% as per HPLC, minimal residual solvents, and careful screening for related phenyl isothiocyanates. For us, this model is a living standard, not a pamphlet figure. Our operators run reactions with the same grade they send to pharmaceutical development labs. Over time, this consistency gave us feedback loops: a chemist from South Korea called us after getting ultra-clean spectra from our material, while another from Europe highlighted the repeatability in coupling reactions. These reports shape our working targets more than any committee ever could.

    Down to the Details: What Sets 2-Bromo-4-Methylphenyl Isothiocyanate Apart

    The world of phenyl isothiocyanates is bigger than textbooks suggest. Substituted versions fall on a spectrum from sluggish to wild in their chemical behavior. In the case of 2-Bromo-4-Methylphenyl Isothiocyanate, the placement of the methyl and bromo substituents subtly changes electronic effects across the ring. This influences reactivity in downstream synthesis—such as nucleophilic addition, formation of thioureas, or even complex pharmaceutical intermediates. The methyl shields part of the ring, while the bromine atom withdraws electron density, tuning the reactivity in selective ways.

    Chemists often compare it with parent phenyl isothiocyanate or the 2-bromo derivative without a methyl group. We notice a tangible difference in the flow of reactions: for example, in coupling processes for pharmaceutical candidates, our compound often gives better selectivity and fewer side-products. For polymer research, the compound introduces polarity and reactivity not found in unsubstituted isothiocyanates. Some collaborators told us that shifting to this model reduced downstream chromatography steps—they trace this back to cleaner conversions.

    An everyday challenge has to do with solubility. 2-Bromo-4-Methylphenyl Isothiocyanate dissolves in most organic solvents, including dichloromethane, ethyl acetate, and toluene—common choices in a synthetic toolkit. We learned to dry our batches over molecular sieves after crystallization to avoid unwanted hydrolysis. While isothiocyanates are generally moisture sensitive, this one tolerates careful handling. Sealed glass bottles with little headspace keep material stable for many months, and we offer volume options tailored for both R&D and industrial scales.

    Real-World Applications: From R&D to Targeted Manufacturing

    Academic and industrial researchers look for fine-tuned building blocks that solve bottlenecks downstream. From our experience, 2-Bromo-4-Methylphenyl Isothiocyanate fills a niche in more than one segment. Medicinal chemistry labs often reach for it in urea and thiourea formation, where the unique substitution pattern influences binding affinities or solubility of finished molecules. Custom API startups have incorporated this substance for exploratory combinatorial libraries, where the subtle changes in polarity and sterics mean better lead diversity.

    Material scientists explored it for polymer modification, cross-linking, and even specialty dye intermediates. We worked with one research client on incorporating the compound for functional surface coatings—data showed strong covalent attachment to amine-rich surfaces, and the results held up even after months. In one industrial project focused on agricultural actives, our product served as a precursor to more complex sulfur-containing heterocycles, helping speed up new candidate screening. We do not just send a bag of chemical out the door; teams often involve us in troubleshooting their process up- or downstream from the isothiocyanate stage.

    Safety, Handling, and Practical Considerations

    Synthetic chemistry works best when the shop floor and lab bench keep risks down. While isothiocyanates have a reputation, the bromo-methyl substituted version does not behave wildly. We ship in tamper-sealed glass or HDPE containers, never metal. We designed our packing process to keep moisture at bay. Prompt transfer from shipping vessel to desiccator gives the best shelf life. Ventilation during weighing is wise, as the isothiocyanate functional group releases a pungent smell if exposed. Gloves and goggles are non-negotiable for our team. Users in formulation and scale-up settings noted similar easy handling, provided they keep things dry and avoid heating during transfer.

    From a manufacturing point of view, our plant shifted to semi-automated batch reactors after a few years fighting scale-up headaches. Early on, over-pressurizing during reagent addition once caused a small containment incident—since then, new sensor arrays flag any deviation and keep the pressure window narrow. Our new lines include emergency neutralization protocols, which we share with bulk purchasers. Factory handling safety forms a key part of our process training, and we pass suggestions to every customer, not just those buying 20 kg drums.

    Comparisons to Other Similar Products

    Often, buyers ask about differences with other isothiocyanates—particularly the unsubstituted or singly substituted phenyl versions. Our technical staff have run reactions using phenyl isothiocyanate, 2-bromophenyl isothiocyanate, and the 2-bromo-4-methyl derivative side by side. The differences show up in real yields: side-product formation drops by 10–15% with the bromo-methyl version, judged by NMR and chromatographic purity after isolation. Downstream purification is easier as fewer volatile sulfur byproducts stick around.

    Looking at competition, some sources cut corners by accepting broader impurity ranges, often to drive price down. We decided not to follow that route, as the feedback from our partners proves the value of delivering a tight spec material. Cheaper batches may save on invoice, but users spend more on rework, lost man hours, or yield losses. In-house, we run repeat syntheses to calibrate process controls, cross-check with multiple detection methods, and keep documentation tightly controlled. Customers reported false economizing by switching to lower grade material, only to return to our product after troubleshooting waste issues.

    Batches from us meet stricter analytical standards, including residual bromide, methylated side products, and moisture levels. We remain involved throughout toll manufacturing agreements, and our staff run site visits or video calls for custom formulation or challenging applications. We treat every buyer as a future collaborator. This way, improvements in one project feed into the quality and performance of the next batch. We draw confidence less from sales figures and more from repeat business and published case studies that trace outcomes back to a higher quality starting point.

    Bridging the Gap: Listening to the Voice of Chemists

    People who use our material are practical and frank. The traffic is not one-way: feedback cycles run from bench chemist to production line and back. Several R&D chemists took pains to highlight how switching to bromo-methyl isothiocyanate trimmed weeks off new project timelines. Some sent us real-world photos of their TLC plates—a victory for us, since it proves things work outside the manufacturer's pitch. In a multi-institutional drug discovery project, an early scale-up using our standard lot led to patent filings not delayed by material supply. The cost per gram faded against the value of a smooth project close.

    Industry partners report that switching from generic isothiocyanates to our specific bromo-methyl variant eliminated certain analytical headaches. Complex aromatic amine couplings run cleaner, both in yield and ease of isolation. Academic labs cite the sharper melting point as evidence of purity, while analytical teams in pharma appreciate the absence of halide or methylated side-products. Some surface chemistry groups in materials science return yearly, updating us on new coating technologies crafted with our product.

    Meeting Future Challenges: R&D, Sustainability, and Collaboration

    We never see a finished chemical as a fixed answer. The way demand has grown for well-defined, functionalized isothiocyanates pushes our team to improve reaction routes and explore greener alternatives. Organic processes are shifting toward less hazardous solvents and improved atom efficiency. For 2-Bromo-4-Methylphenyl Isothiocyanate, our pilot trials use alternative bromination agents and explore solvent recycling at scale. These are not cost-saving ploys. Our operators know that improved yield and cleaner batches pay back at the bench, with less waste and higher efficiency for our clients.

    People ask about environmental impact. Isothiocyanate chemistry carries waste concerns, particularly during cleanup or disposal steps. We catch these issues early. At the factory, we run closed-loop solvent recovery, strive to minimize hazardous effluent, and conduct regular reviews of our handling protocols. Used solvents and byproducts are treated via on-site facilities or contracted incineration, ensuring little makes its way to landfill. Some buyers now factor green chemistry ratings into their purchasing. To stay competitive, we track sustainability metrics and pass verified data to bulk customers without waiting for regulatory mandates.

    As chemists, we approach every inquiry as a partnership. Some clients bring up new synthetic routes where bromine placement impacts functional group compatibility. Others work on complex scaffolds for high-value targets—here, we support method development or even trial early-stage intermediates before commercial volumes are agreed. This willingness to collaborate came from years spent not as a job lot supplier, but as a technical resource at the end of a phone or email. Our history shapes every new batch, with hands-on adjustments that respond to what our customers face at the bench, not trends set by anonymous brokers.

    Reliable Supply Chains Start with Manufacturing Experience

    Upstream, we learned the hard way about raw material quality. Early batches suffered when upstream brominated stocks came from poorly run suppliers. Over time, we converted sourcing to vetted vendors with clear documentation, insisting on analytical certificates and sample lots before agreeing to contracts. Whenever a particle size fails, or a color shift flags unknown impurities, we pull the lot from production. Many suppliers favor speed. We prefer to wait for the right material; our buyers understand that every shortcut shows up later in their own work. By now, our specs are tighter than many published in online catalogues—one way to show respect for the people who rely on what we make.

    Supply interruptions and shipping issues remain a reality in today's business. We built long-standing relationships with carriers who handle sensitive chemical deliveries, explained quirky customs documents to brokers, and even adapted labeling to meet changes in international freight rules. While others scrambled during global supply shocks, repeat business with core clients proved that tight coordination pays off. Regular updates about stock, shipping times, and paperwork avoid misunderstandings, and our internal system flags any delivery risk before it becomes public. Clients stay informed. It is not a slogan; it is hard-won discipline from seasons of missed deadlines and the memory of lost opportunities.

    The Value of Reliability in Advanced Fine Chemicals

    2-Bromo-4-Methylphenyl Isothiocyanate may look like just another pale crystalline powder, but in the modern synthesis lab, quality and reliability drive results. We built our business learning from users' feedback, double-checking details others ignore, and refining our process at the intersection of technical rigor and open communication. Every bottle or drum that leaves our plant carries not just a chemical substance but the reputation that comes from focus and care at each step. The difference shows up under the lens of an NMR, in the speed of a clean coupling, or in the fewer hours spent troubleshooting mystery byproducts.

    Real manufacturing skill does not come from press releases or glossy catalog entries. Our story with 2-Bromo-4-Methylphenyl Isothiocyanate, like many specialty fine chemicals, was written by long hours, direct conversations, and lessons learned batch by batch. The final measure is not a bullet point of attributes, but the trust we earn when chemists and process engineers return for the next project—knowing that the material in the bottle will do exactly what they hope, and sometimes, a bit more.