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4-Bromo-2,2-Diphenylbutyronitrile

    • Product Name 4-Bromo-2,2-Diphenylbutyronitrile
    • Alias 4-Bromo-2,2-diphenylbutyronitrile
    • Einecs EINECS 252-120-9
    • 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

    166367

    Product Name 4-Bromo-2,2-Diphenylbutyronitrile
    Cas Number 35720-36-6
    Molecular Formula C16H14BrN
    Molecular Weight 300.20 g/mol
    Appearance White to off-white solid
    Melting Point 81-84 °C
    Density 1.28 g/cm³ (estimated)
    Solubility Slightly soluble in organic solvents
    Purity Typically ≥98%
    Smiles N#CCC(Br)C(c1ccccc1)c2ccccc2
    Inchi InChI=1S/C16H14BrN/c17-13-12-16(15-9-5-2-6-10-15,14-11-7-3-1-4-8-14)18/h1-10H,12-13H2
    Storage Conditions Store in a cool, dry place

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

    Packing & Storage
    Packing The chemical `4-Bromo-2,2-Diphenylbutyronitrile` is supplied in a 25-gram amber glass bottle with a secure screw cap.
    Shipping 4-Bromo-2,2-Diphenylbutyronitrile is shipped in tightly sealed containers, protected from moisture and light. It is classified as a hazardous chemical and must comply with local and international shipping regulations. Proper labeling and documentation are required, and transportation should be conducted by certified carriers specializing in chemical substances.
    Storage 4-Bromo-2,2-Diphenylbutyronitrile should be stored in a tightly sealed container, away from moisture and light, in a cool, dry, and well-ventilated area. Keep the chemical away from incompatible materials such as strong oxidizing agents and acids. Properly label the container, use secondary containment to prevent leaks, and ensure access is restricted to trained personnel only.
    Application of 4-Bromo-2,2-Diphenylbutyronitrile

    Applications of 4-Bromo-2,2-Diphenylbutyronitrile in Industrial Manufacturing

    As an experienced chemical raw material manufacturer, we supply 4-Bromo-2,2-Diphenylbutyronitrile for specialized sectors that demand advanced intermediates. Our product supports downstream integration in high-value applications, focusing on niche pharmaceutical, agrochemical, and specialty chemical synthesis. Each of the following industrial scenarios uses this compound for core process steps—ensuring compliance, cost-efficiency, and end-product reliability at scale.

    1. Pharmaceutical Intermediates for Non-Steroidal Anti-Inflammatory Drugs (NSAIDs)

    Leading active pharmaceutical ingredient (API) manufacturers rely on this material as a key intermediate in multi-step syntheses for select NSAID compounds, supporting intricate ring closure and side chain modification reactions. Downstream pharmaceutical production incorporates this material during advanced synthetic stages, ensuring high yield in custom API manufacturing for the regulated market.

    Industry compliance standards

    • ICH Q7 Good Manufacturing Practice for Active Pharmaceutical Ingredients
    • European Pharmacopoeia (Ph. Eur.) for APIs
    • US FDA 21 CFR Part 211 for finished pharmaceuticals
    • Chinese Pharmacopoeia for local market supply

    Typical usage ratio

    • 3-7% w/w as a primary starting intermediate, adjusted according to the targeted molecular scaffold in API libraries

    Downstream process integration

    • Introduced as a building block in the intermediate coupling and cyclization step, following preliminary precursor preparation and preceding final crystallization and purification

    Final product types

    • Non-steroidal anti-inflammatory pharmaceutical actives (e.g., custom-proprietary molecules)
    • Contract manufactured advanced pharmaceutical intermediates

    2. Synthesis of Agrochemical Active Substance Intermediates

    Agrochemical producers apply this compound in the custom synthesis of phenyl-substituted nitrile and amine intermediates used to build complex insecticidal and fungicidal molecules. Its reactivity facilitates downstream halogen exchange and nitrile reduction, producing high-purity intermediates within tightly controlled process environments.

    Industry compliance standards

    • FAO/WHO Specifications for Plant Protection Products
    • ISO 9001 Quality Management Systems
    • REACH Regulation (EC) No 1907/2006 for European market access
    • China National Standards (GB) for Pesticide Manufacturers

    Typical usage ratio

    • 2-5% w/w in the primary reaction mass, tuned by molar equivalence for target intermediate yields

    Downstream process integration

    • Fed into the initial condensation or coupling reaction, followed by catalytic hydrogenation and further heterocycle formation, integrated within multi-step custom synthesis lines

    Final product types

    • Custom advanced intermediate compounds for use in insecticide synthesis
    • Building blocks for systemic fungicide APIs

    3. Fine Chemical Building Block for Specialty Polymer Additives

    Producers in the specialty chemical sector incorporate this raw material during the custom manufacture of high-performance phenyl-substituted additives, which are later used to formulate improved impact resistance in engineering plastics and specialized polymer blends for electronics and automotive applications.

    Industry compliance standards

    • ISO 14001 Environmental Management Systems
    • RoHS (Restriction of Hazardous Substances) Directive for electronics
    • UL 94 Flammability Standard for plastic materials
    • ASTM D638 for physical testing of plastics

    Typical usage ratio

    • 0.5-1.5% w/w based on target additive concentration required for end-use performance enhancements

    Downstream process integration

    • Reacted during additive synthesis, introduced in early-stage batch reactors before post-processing with plasticizers; integration directly affects chain structure and functional group incorporation

    Final product types

    • Polymer additive masterbatches for engineering resins
    • Impact modification components for high-value thermoplastics

    4. Advanced Intermediate for Chiral Ligand and Catalyst Production

    Manufacturers serving organometallic and homogeneous catalysis markets leverage this compound to synthesize diphenylbutyronitrile-based chiral ligands, used extensively in enantioselective hydrogenation and cross-coupling catalyst systems. The material’s structural motif enables targeted modification of both electronic and steric ligand properties for downstream catalysis innovation.

    Industry compliance standards

    • ISO 9001 Quality Management Systems for specialty chemicals
    • GLP (Good Laboratory Practice) for laboratory and pilot synthesis
    • Responsible Care® Global Charter for environmental and safety performance

    Typical usage ratio

    • 0.8-2% w/w in ligand and catalyst intermediate synthesis reactions, optimized for chiral selectivity constraints in downstream processes

    Downstream process integration

    • Input into the ligand precursor formation stage, entering during nitrile conversion and functional group derivatization prior to complexation with transition metals

    Final product types

    • Custom diphenylbutyronitrile-derived chiral ligand products
    • Homogeneous catalyst complexes for fine chemical synthesis (e.g., asymmetric hydrogenation)
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    Certification & Compliance
    More Introduction

    4-Bromo-2,2-Diphenylbutyronitrile: Real-World Performance and Practical Know-How

    Recognizing the Role of 4-Bromo-2,2-Diphenylbutyronitrile in Synthesis

    After years in chemical manufacturing, patterns emerge about which intermediates streamline synthesis. 4-Bromo-2,2-Diphenylbutyronitrile (CAS No. 85064-68-0) stands out because of its stable structure and manageable reactivity. Working directly with a compound rather than sourcing through a distributor gives firsthand experience with selectivity, handling, and how the molecule reacts under scale-up conditions. Production starts with a focus on key performance traits—purity, crystalline form, moisture content, and predictable melting range. In workups, impurities complicate hydrogenation steps and building block alignments, so controlling the input purity affects downstream process safety and efficiency, not just cost. Consistent material gives medicinal chemistry teams a stable backbone for new drug candidates and lets process engineers scale from grams to multi-kilo batches without headaches over batch-to-batch variability.

    How This Molecule Finds Value in Pharmaceutical Research and Beyond

    Projects in pharmaceutical R&D move fast, and teams need intermediates that unlock more complex molecules. The butyronitrile backbone forms a stable base, and the electron-withdrawing bromo group improves reactivity in cross-coupling and nucleophilic displacement steps. When labs move from milligram libraries to multi-kilo pilot plant campaigns, handling properties like flowability and particle size start to matter just as much as reactivity or theoretical yield. Quality controls at the plant gate—checking for residue solvents, water by Karl Fischer, and color by USP standards—directly affect the speed at which a team can move from receiving drums of material to charging the reactor. Experience on the production floor shows that crystalline 4-Bromo-2,2-diphenylbutyronitrile resists caking and stays stable on the shelf, sparing teams from headaches when weighing and feeding. This reliability removes unnecessary troubleshooting and lets researchers and production chemists focus on what counts: delivering the next step in synthesis with confidence that the input really matches their protocol, not just the paperwork.

    Differences from Other Nitriles in the Toolbox

    Comparing this molecule to standard aliphatic nitriles or non-brominated analogues highlights a few things few notice until chemists run the reactions themselves. Its steric bulk and aromatic diphenyl structure lets it play roles that simple n-butyl or benzyl nitriles cannot match, especially in producing densely substituted scaffolds that show up in advanced pharmaceutical targets. We have seen that aliphatic nitriles often lack the reactivity needed for productive coupling in Suzuki–Miyaura or clay-catalyzed condensation—yield can drop, and selectivity suffers. Using 4-Bromo-2,2-diphenylbutyronitrile, the bromide's ortho position supports improved rates of organometallic insertion, giving higher conversion and clean up. Lab work at our plant demonstrated this behavior in several custom syntheses for early-stage drug candidates, where this intermediate cut purification steps down and kept reactions robust, with better overall mass balance. This saves waste, time, and cost at scale.

    What End Users Report About Functionality and Process Fit

    Feedback comes from pharma process chemists and CRO labs scaling up intermediates for toxicology or formulation studies. They care about how intermediates dissolve or suspend, how they survive isolations, and what real analytical results show compared to the data sheet. Users measuring NMR integration after 24-hour stirring at room temperature see stable profiles, showing the molecule survives extended handling. In one run at our facility, a team loaded 2-kg charges into pilot glass reactors for a sequence in aryl amine construction. They reported smooth filtration, minimal product lost to glassware, and reliable NMR shift data—no surprises, no ghost peaks, and satisfaction for batch release testing. By contrast, a test batch from an outside supplier introduced trace halide contaminants, forcing extra purification. This kind of real process bottleneck sets back program timelines by days, can add thousands in cleaning, and damages confidence. It matters that material from the source runs according to plan, not just according to literature.

    Tangible Advantages During Scale-Up

    Process engineers have explained how fine differences present theoretical and practical benefits. When we compare our 4-Bromo-2,2-diphenylbutyronitrile to similar molecules without the bromo group, the improved leaving group ability speeds up alkylation steps. At the two-hundred-kilo scale, incomplete reactions make for complicated product splits and wasted solvent. Watching reaction curves in real time, teams report sharper endpoints and fewer mixed phase separations. Loss in liquid–liquid extractions drops, usually below 2%, because the product partitions more readily. This is a significant step up from weaker analogues, which lengthen cycle times and muddy recovery rates. Handling in the warehouse matters too: stable crystals store well and resist moisture pick-up. We’ve stored drums in both humid and dry conditions to observe performance— weeks down the line, the product retains expected melting point and shows less than 0.1% water content by KF. That keeps process audits easy and saves costs on repack and reanalysis.

    Real World Logistics: Packaging, Shipping, and Storage Experience

    On the manufacturing side, each intermediate brings a cargo of concerns: what happens in transit, during customs, or sitting on a dock. We switched to high-density polyethylene drums and triple-sealed liners after early lessons with plastics that leached. In trials with both drums and fiberboard boxes, crystal retention and physical integrity were far superior in HDPE drums. Staff tracking pallets see no significant product caking or bridging, regardless of shipping season. For longer routes or slow customs clearance, the molecule’s resistance to hydrolysis or UV-induced degradation helps maintain quality. Shipping into regions with variable regulatory requirements, purity documentation, and transit time frequently requires shipment sampling. Our experience shows that well-packed, well-documented shipments lead to fewer site quarantine periods and faster acceptance by receiving sites. The right packing keeps the project on schedule, and fewer delays help downstream customers, even outside pharma, keep their own fine chemical or electronics projects moving.

    Hazard Management and Safe Handling: On-the-Ground Learning

    Following safety protocols in chemical storage and handling, especially with aromatic nitriles bearing bromides, cannot be skipped. Teams learn in practice how even a trace spill releases strong odors and may demand extra PPE. Our on-site experience repeatedly confirms the need for simple but often-overlooked basics: ventilation, spill trays, and regular drum inspections. Segregation from acids, alkalis, and oxidizing materials prevents unplanned reactivity. Teams performing small scale reactions comment how personal protective gear and dust control help avoid skin or eye contact, which reduces incidents. Plant workers see faster clean-up after minor spills compared to more volatile intermediates, meaning downtime is reduced and product losses stay low. Careful process design, especially around mixing and sampling points, reinforces trust in the workflow. On representative batches, workplace air analysis confirms exposure stays below regulatory thresholds, provided good ventilation and work practices. Keeping training current, especially as younger technicians join, helps ensure the next workflow generation learns best practice from day one.

    Forging Better Chemical Pathways in Custom Manufacturing

    Manufacturers face a choice between making commodities at volume or specializing in building blocks that drive innovation. Our hands-on experience preparing 4-Bromo-2,2-diphenylbutyronitrile over hundreds of batches gives insights not just on reaction yield, but on what it takes to run an agile, responsive synthesis program. Custom orders for tight impurity thresholds or novel particle size cuts are more common than single-standard grades. Chemists in custom manufacturing use feedback loops from client-side synthesis, adjusting purification or crystallization to meet fine purity specs demanded for pilot projects or regulatory submissions. By running columns in parallel, adjusting solvent ratios, or modifying crystallization regimes, real improvements are made batch by batch. This adaptability not only moves new chemical entities (NCEs) forward in preclinical studies, but reduces waste and cost for all involved. With years of data guiding process decisions, optimization no longer means guesswork—it’s about controlled steps producing real, reproducible gains.

    Role in Green Chemistry and Sustainable Production Initiatives

    Sustainability doesn’t mean lowering expectations—it means smarter operation. Items like 4-Bromo-2,2-diphenylbutyronitrile, where bromination or cyanation can generate hazardous byproducts, prompt the adoption of closed systems, solvent recovery, and digitized monitoring throughout the plant. We have seen double-digit reductions in waste solvent output by investing in continuous flow systems and real-time probe monitoring—value confirmed by lower wastewater treatment costs and regulatory compliance. Selecting supporting reagents with lower environmental risk, and systematically recycling crystallization solvents, reduce overall environmental load. Compliance with REACH and other major chemical safety initiatives keeps both our teams and end-users on safe footing. Auditable production records reflect not only traceability for each batch, but real benchmarks for energy, water, and chemical use year over year.

    Downstream Integration—Adaptability in Related Industries

    Pharmaceutical teams aren’t the only beneficiaries. We’ve seen electronics and specialty polymer customers leverage the unique reactivity of the molecule’s bromo and nitrile groups in producing advanced monomers and specialty ligands. Differences in purity or moisture content make clear impacts on chip yield or polymer chain length. Working with electronic applications, our teams shifted moisture controls tighter and invested in drum drying systems for microelectronics-grade output. This led to a marked decrease in rejection rates and allowed customers to use the material in higher-sensitivity applications with confidence. Reaching beyond pharma means listening to a wider set of needs, then tuning production and QA for each segment. Lab work showed that some applications required custom sieving or micronization for better processability, showing there’s rarely a one-size-fits-all approach—meaning genuine feedback loops drive welevolutions in process and packaging.

    Quality Oversight in Modern Chemical Manufacturing

    Today’s market demands real-time quality oversight, not just batch sampling. By implementing strict in-process controls—HPLC, GC-MS, melting point checks, and Karl Fischer at defined checkpoints—our facility ensures that no batch proceeds through packing without thorough sign-off. Out-of-spec trends are addressed before they leave the reactor, sparing avoidable recalls or disputes. Experienced analytical chemists run final confirmation on each batch before shipment. Feedback loops from each customer batch return help continuously refine process variables. These insights aren’t academic—they point to yield maximization, cost control, and improved safety for site, shipper, and user alike. With customer audits trending toward traceability and analytics, a plant that stays ahead of documentation requirements builds not only compliance, but customer loyalty.

    Ongoing Collaboration—Solving Problems Directly With End Users

    Real process improvements rarely happen in isolation. Weekly calls, in-field visits, and NMR troubleshooting sessions with end user R&D teams help drive the evolution of both product and production process. More than any data on a label, it’s these day-to-day conversations—where a late shipment, yield drop, or crystallization hiccup becomes a shared challenge—that guide the next production run. Cases where a formulation change requires a new impurity threshold frequently prompt upgrades in purification. Without openness about reaction conditions and user demands, optimization stalls. Effective partnerships turn supply into innovation—varied routes, optional service grades, tailored pack size—real answers for real industrial hurdles.

    Process Safety Observations—Lessons From Real Batches

    Nothing replaces direct plant experience for process safety. Watching a filtration block up, or seeing unexpected foam during solvent swaps, focuses attention on practical hazard control—far more than any protocol checklist. Minor adjustments, like slow temperature ramping during batch addition or fine-tuning agitation rates, reduce both minor incidents and catastrophic failures. Operating reactor trains and handling drum logistics under real deadlines provides understanding that isn’t found in safety data sheets or academic publications. In every instance, regular safety drills, improvement audits, and lessons learned from near-misses shape not just compliance culture but genuine operational reliability from batch start to drum loading dock.

    In São Paulo or Singapore—Global Reach and Product Consistency

    Chemical manufacturing in a global economy means understanding the unpredictability of shipping, customs, and end-user expectations. Experience has repeatedly shown that planning, documentation, and real-time communication on product release and transit timing are as important as synthetic quality. Shipments to pharmaceutical multinationals or specialty polymers customers in the Americas, Europe, or Asia consistently highlight the value of loading checks, physical seals, supply chain transparency, and rapid documentation sharing. Site-to-site audits often uncover minor discrepancies in labeling or paperwork—fixable only by a manufacturing team that remains responsive and anticipates what’s required by end-users and regulators alike. Building trust at every step comes from repeated, verifiable product performance and open, honest reporting.

    Why Consistency Matters in Highly Regulated Markets

    The true test for a chemical intermediate comes in a regulated audit or after a deviation investigation. Avoiding compliance findings relies not only on documented quality, but on a history of batch-level stability, real supply chain transparency, and an ongoing willingness to work with end-user QA and regulatory teams. Regulatory sites want coherent lot histories, tightly controlled impurity levels, and answers on anything from residual solvents to product genealogy. In the tight regulatory environment of pharmaceutical or electronics intermediates, minor variability can translate to millions in additional validation work or lost time. Meeting these high standards comes from day-to-day discipline on the shop floor, lab bench, and shipping dock—a commitment that pays off for both supplier and customer.

    Pathways for Future Process Development

    Feedback from synthetic and process chemists helps drive the evolution of building block production. With the shift toward continuous flow processes and integrated analytics, intermediates like 4-Bromo-2,2-diphenylbutyronitrile benefit from new real-time monitoring and feedback control, yielding tighter impurity profiles and less process waste. This approach ensures steady quality and supports innovation, both for next-generation pharmaceuticals and advanced materials. Insights gained from close collaboration enable manufacturing to stay at the forefront of evolving synthetic strategies, supporting users as they pioneer new routes and products.

    Why Direct Manufacturer Experience Changes the Game

    Sourcing intermediates directly from manufacturing sites means more than a price point or a data sheet promise. Years of firsthand synthesis, purification, and product handling shape a deeper understanding of every nuance—from impurity tracking and shelf stability to transport resilience. This insight provides a real advantage to downstream chemists, process engineers, and R&D teams who rely on intermediates to move projects forward efficiently. Supporting each user with tailored process advice, options for grades or pack size, and responsive troubleshooting comes naturally when the manufacturer speaks from experience. Those details can be the difference between hitting a critical milestone or losing valuable time—a difference that’s felt in daily practice across pharmaceuticals, electronics, and specialty chemical production.