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HS Code |
400876 |
| Chemical Name | Benzhydryl Isothiocyanate |
| Cas Number | 3585-59-5 |
| Molecular Formula | C14H11NS |
| Molecular Weight | 225.31 g/mol |
| Appearance | White to off-white solid |
| Melting Point | 92-94 °C |
| Solubility | Slightly soluble in water, soluble in organic solvents |
| Boiling Point | 356.1 °C at 760 mmHg |
| Purity | Typically ≥98% |
| Density | 1.17 g/cm³ (approximate) |
| Storage Conditions | Store in a cool, dry place, tightly closed container |
| Synonyms | Diphenylmethyl isothiocyanate |
| Iupac Name | benzhydryl isothiocyanate |
| Smiles | N=C=S C(c1ccccc1)c2ccccc2 |
| Refractive Index | 1.670 (predicted) |
As an accredited Benzhydryl Isothiocyanate factory, we enforce strict quality protocols—every batch undergoes rigorous testing to ensure consistent efficacy and safety standards.
| Packing | A 25g amber glass bottle with a secure screw cap, labeled "Benzhydryl Isothiocyanate," displays hazard symbols and handling instructions. |
| Shipping | Benzhydryl Isothiocyanate should be shipped in tightly sealed containers, kept cool, dry, and well-ventilated. It is classified as a hazardous chemical and should be handled and transported according to local, national, and international regulations for toxic substances, including correct labeling and documentation to ensure safe and compliant delivery. |
| Storage | Benzhydryl Isothiocyanate should be stored in a tightly closed container, in a cool, dry, and well-ventilated area away from sources of ignition and incompatible substances such as strong oxidizers and acids. Protect from light and moisture. Store at room temperature and handle using appropriate personal protective equipment to prevent inhalation, ingestion, or skin contact. |
Applications of Benzhydryl Isothiocyanate in Industrial ManufacturingBenzhydryl Isothiocyanate serves as a specialized chemical intermediate in multiple downstream industries. Leveraging strong reactivity in organic synthesis, manufacturers use this raw material in several controlled process environments, where regulatory guidelines and technical requirements shape its application scope. Below, we detail key industry sectors and processing pathways where Benzhydryl Isothiocyanate forms a critical part of end-product manufacturing. 1. Pharmaceutical Active Ingredient SynthesisOur facility supplies Benzhydryl Isothiocyanate directly to pharmaceutical manufacturers for the synthesis of target molecules within API development. Notably, the isothiocyanate functionality permits selective construction of nitrogen–sulfur-linked scaffolds that augment heterocyclic compound portfolios, especially in antihistamine and oncology research. Customers integrate this intermediate at mid to late-stage synthesis, where strict documentation, traceability, and impurity profiling are enforced throughout process validation, impacting drug candidate selection and scale-up to GMP batches. Industry compliance standards
Typical usage ratio
Downstream process integration
Final product types
2. Agrochemical Intermediate ProductionBenzhydryl Isothiocyanate enables the synthesis of advanced intermediates used in crop protection formulations. Agrochemical manufacturers employ the isothiocyanate group to build bioactive moieties targeted at selective herbicidal, fungicidal, or insecticidal actions. The integration occurs at late-stage heterocycle formation or thioamide linkage steps, where raw material purity and trace volatile impurities must comply with agricultural residue stipulations and environmental regulations for field application. Industry compliance standards
Typical usage ratio
Downstream process integration
Final product types
3. Specialty Polymer Modifier ManufacturingIn high-performance plastics and elastomers, Benzhydryl Isothiocyanate functions as a functional group modifier to introduce sulfur-containing linkages. Polymer producers utilize this intermediate at chain extension or crosslinking stages to impart thermal stability or flame retardancy to specialty resins. Quality control focuses on isothiocyanate group integrity and low moisture content to prevent undesired polymer chain termination or suboptimal network formation in the final compound. Industry compliance standards
Typical usage ratio
Downstream process integration
Final product types
4. Fine Chemical Synthesis for Dye and Pigment ManufactureThe material finds utility as an intermediate in synthesizing sulfur-containing dyes and specialty pigments. Dye manufacturers employ isothiocyanate-based chemistry to construct customized chromophores for textile, ink, and plastics coloration. Processing demands high-reactivity and precise stoichiometry, as chromophoric ring formation via this raw material defines the color fastness and environmental profile required for legal export to regulated markets. Industry compliance standards
Typical usage ratio
Downstream process integration
Final product types
5. Chemical Research and DevelopmentContract research organizations (CROs) and in-house R&D centers actively use Benzhydryl Isothiocyanate as a reagent for chemical library synthesis, SAR studies, and structure modification work. The compound enables rapid access to a broad set of S- and N-linked derivatives to support lead optimization and patent extension strategies. Research chemists demand high analytical documentation, batch traceability, and exact composition reporting for reproducibility and regulatory submissions. Industry compliance standards
Typical usage ratio
Downstream process integration
Final product types
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In our daily work at the chemical plant, benzhydryl isothiocyanate keeps showing up as a backbone molecule for a surprisingly wide spectrum of projects. This product, with a structure marked by its two phenyl rings and isothiocyanate group, has carved a stable reputation as a specialty reagent in advanced synthesis, and there are plenty of good reasons for this consistency. Our team, with years of process experience behind us, continues refining production steps and quality habits because so many researchers and downstream manufacturers expect absolute reliability from this compound.
Benzhydryl isothiocyanate, or diphenylmethyl isothiocyanate as it’s sometimes known (CAS Number: 886-95-9), shows up in a clear to pale yellow powder, distinctive both in smell and handling. Chemists know its core formula (C14H11NS), but actually producing it consistently without introducing chromatic impurities takes genuine discipline at every batch scale. Our crew works with models typically hitting a 98% purity mark, measured by GC or HPLC, with special attention paid to trace byproducts because these can impact downstream reactivity.
Demand for this compound often draws from research labs, pharma intermediates, agrichemical developers and R&D units chasing new molecular scaffolds. Benzhydryl isothiocyanate falls into a sweet spot: it works as a building block for synthesizing thiourea derivatives, sulfonamides, and urea-linked pharmaceuticals. Each day, requests come in from synthetic chemists who rely on its performance to craft new N-heterocycles or to introduce isothiocyanate groups into larger frameworks where alternative routes fall short.
In the pharmaceutical industry, sturdy reaction control becomes everything. Our product offers consistent melting points, and the batch-to-batch repeatability means fewer requalification headaches for production chemists. Specialist formulators appreciate the crystalline appearance, noting that true purity equates to fewer side-reactions or unexplained colorations in follow-up chemistry—something that’s tough to guarantee without tightly monitored raw material inputs. Product developers integrating benzhydryl isothiocyanate into their scaling pathways often stop us at trade events to discuss subtle points like solubility differences across solvent systems, issues only apparent when you spend enough time on the plant floor or at the bench.
From conversations with users, we’ve gathered that benzhydryl isothiocyanate finds a firm foothold in medicinal chemistry screenings. For example, it features in Mannich-type reactions, where it introduces the isothiocyanate moiety cleanly, or in more bespoke nucleophilic substitutions that set up new bioactive cores. Our in-house chemists pick up many of these stories, often working with academic partners who rely on tight supply chains and proof-of-origin traceability. The importance of careful production design becomes clear—minor slips at the synthetic or purification step can leave end users spending extra effort troubleshooting problems that arise far downstream.
Making benzhydryl isothiocyanate at scale isn’t just a question of reacting the right starting materials—it means grappling with raw material consistency, temperature control, and a delicate purification process. Only by controlling every variable can we avoid cross-contamination and batch inconsistency. Over the years, our operators developed a routine for monitoring color and assay purity at several points, because impurity drift can lead to headaches for anyone relying on clean spectra or sharp melting points.
The typical specification at our plant calls for at least 98% purity, but the challenge often comes from avoiding trace aromatic byproducts with similar solubility. We’ve devoted a substantial portion of our R&D to optimized crystallization and filtration systems for this very reason. A high-purity benzhydryl isothiocyanate can be distinguished by its crisp crystalline form; any cloudiness or yellowing acts as a signal to double-check source reagents or revisit purification protocols.
While benzhydryl isothiocyanate stands tall for certain synthetic purposes, it’s not the only isothiocyanate flowing through the reactors here. To our eyes on the production floor, its differences start with the bulk of its diphenyl structure, which confers distinct reactivity and handling traits when put next to something simpler like phenyl isothiocyanate.
Phenyl isothiocyanate, widely used for derivatization or as an amine-labeling reagent, appears more volatile and carries higher inhalation risk—process operators need to keep airflow and PPE top of mind. Benzhydryl isothiocyanate, bulkier and a bit more stubborn, handles with fewer vapor hazards but does require special care to avoid mechanical breakdown or static dust formation. Its higher melting profile makes storage less troublesome, a simple but meaningful point for end users running large series in the lab.
Downstream, synthesis teams tell us that benzhydryl isothiocyanate offers a better leaving group under certain reaction schemes because of the phenyl resonance effect. Many academic groups report improved yields in the functionalization of certain aliphatic amines—something we validate through small-scale pilot work before scaling for major deliveries. The weight and steric bulk of the benzhydryl moiety also block side-reactions and cut down on undesired polymerization, compared to lighter substitutes. Process specialists routinely contact us to discuss these fine points, debating whether classic alternatives like methyl or ethyl isothiocyanate can really substitute when selectivity matters.
Working with isothiocyanates means confronting both synthetic opportunity and chemical risk. Benzhydryl isothiocyanate allows for higher-precision syntheses, particularly in late-stage functionalization, while delivering a lower volatility profile than slimmed-down analogs. In practical plant terms, we see fewer incidents involving airborne loss compared to smaller-molecule relatives, simplifying air handling and reducing odor complaints. This has let us tighten up containment and streamline transfer steps, which becomes especially important as production scales upward.
During scale-up trials, our team has witnessed firsthand how different packing methods and storage durations can affect product quality. Large-scale bins need to control moisture; this compound isn’t as hydrophobic as its methyl isothiocyanate cousin, but it still blocks up fast if you ignore air-tight seals. Chemists on our line take pride in over-prepping storage drums, a small but critical detail learned through years of hands-on frustration with caked or clumped raw material when it comes time to batch out a kilo-scale order for a repeat user.
Environmental responsibility weighs heavily on our planning. Unlike volatile, foul-smelling isothiocyanates, this product simplifies local emissions management. Still, strict PPE, improved dust collection systems, and thoughtful operator training never go out of style. Safety data and workplace hazard mitigation aren’t just paperwork hurdles—they’re practical decisions rooted in dozens of small, daily interventions from our plant personnel. Feedback loops with customers reinforce that a slip in purity or packaging can start a string of avoidable failures, so every day remains a new challenge to meet or beat our own benchmarks.
As contract and catalog sales both grow, the pressure to maintain tight specifications gets steeper. Specifications like melting point range (usually 68–71°C in our workshops), color stability, and cleanliness define the margin between a batch that ships and one that gets blended back for reprocessing. We audit every production run, taking cues from HPLC purity traces and NMR scans before documents clear a batch for outbound shipment. If the feedback points to problems—off-color, wetness, or unexpected peaks in the spectrum—the pull to intervene isn’t theoretical. It’s the simple reality: we know how fragile customer timelines can be, and a single batch glitch can throw off not just one project, but multiple downstream processes.
Customers invested in drug discovery or analytical standards appreciate the small touches: air-tight packaging, desiccant pouches, and transparent batch records. In our experience, pharma clients want sample-size flexibility because early reactions rarely clarify how much of the intermediate they’ll need long-term. We regularly split finished lots into study packs, multi-kilo containers, or smaller R&D sample jars depending on the project scope. Researchers and scale-up teams often praise this flexibility, pointing out that larger chemical houses sometimes force single-size shipments that complicate inventory.
Whereas many catalog intermediates acclimate well to automation, benzhydryl isothiocyanate resists shortcuts. Manual control—by skilled operators who know precisely when a batch “smells” or “looks” off—remains central. Relying on automation alone left us scrambling in the past when temperature drifts led to subtle decomposition during the exothermic introduction of isothiocyanate. Now, senior operators tracks each batch personally and flag even minor variations from baseline color or pourability. This standard comes directly from prior production headaches, where rejecting suspect intermediates early saved downstream users considerable trouble.
With scale comes the need for new approaches to filtration. Benzhydryl isothiocyanate, on cooling, has a nasty habit of encasing itself in thick, slow-draining cakes, unlike lighter isothiocyanates, which filter clear with a simple Buchner funnel setup. We’ve adjusted protocols—changing out filter cloth porosity, tweaking solvent systems, increasing vacuum settings—all in pursuit of cleaner isolation. Consistent filtration strategy matters, because end users need powder that handles smoothly, resists caking, and redissolves predictably.
Many times during plant upgrades, we’ve confronted infrastructure crossroads: upgrade for faster throughput, or slow down for better selectivity. For this product, slower wins out. Pushing throughput in early reactors, especially on hotter or more concentrated runs, led us to more off-color product and tough-to-remove impurities—lessons we carry still. Our approach rewards careful monitoring and a willingness to give up some potential volume for higher purity and satisfied partners.
Trends in modern chemistry put increasing value on specialty intermediates like benzhydryl isothiocyanate. As combinatorial and fragment-based synthesis gain steam, more researchers reach out with custom requests: minor adjustments in melting point requirements, tighter impurity windows, or specific packaging needs tied to collaborative projects spanning universities or multinational teams. Our development chemists constantly field queries about custom labels or co-crystallization assistance for joint R&D. Every one of these requests starts with a clear understanding of what true product quality means—not only analytically, but in the practical, repeatable outcomes it delivers for users.
We listen when research groups report back special findings about reactivity shifts, or when process engineers ask for shipment in tailored containers that suit their hazardous material management protocols. Simple changes, such as introducing new anti-static bagging or double-lining drums for humidity control, can end up saving a full project cycle. Many of our packaging and shipping adjustments now trace to customer feedback gathered across years of direct conversation, not just from sales reps but from bench scientists and production plant operators in the field.
The biggest difference between direct manufacturers and those outside the plant comes down to day-to-day responsibility. Each chemical shipped carries a simple record—who watched the batch form, who entered assay data, who loaded the drums. Our group leads and QA chemists see far beyond catalog numbers or order forms. They build processes for benzhydryl isothiocyanate that start at the raw material dock and end in the hands of users several countries away, and each step calls for practical, experience-driven decision making.
Since early days, the team has chosen to measure customer satisfaction not just on paper, but via follow-up projects: hearing which batches performed cleanly, which ones ran into snags with unexpected side reactions, and which features mattered most in daily lab routines. Manufacturer-level insight means never splitting focus between new product launches and the day-to-day work of getting every batch to spec. All QC samples remain archived, every anomaly noted—lessons that feed right back into subsequent process improvement. Regular production audits and trial runs let us fine-tune reactor conditions or update SOPs when new raw material lots behave oddly.
Demand never stays static, so we keep adjusting to peaks and valleys. During challenging years, like raw material spikes or logistics shortfalls, the team’s ability to keep benzhydryl isothiocyanate both in stock and within spec has drawn direct praise from long-term customers. Those end users trust that each batch comes grounded in a simple promise: the same standards, the same people checking every step, the same open line for technical feedback.
For chemists hunting reliable tools, benzhydryl isothiocyanate supplies a foundation they can build on. The fact that a specialty molecule like this endures across so many novel projects comes down to reliable manufacture and honest collaboration. On the plant floor, staff value transparency—communicating openly about batch challenges, sharing notes on minor drifts outside normal assay or melting point targets, and working together with customers to troubleshoot unplanned roadblocks during product scale-up.
A molecule’s success or failure in the end user’s hands rides on more than just published specs. Truthful batch history, accessible certificates of analysis, and the personal accountability of the actual production staff all combine to reinforce trust. That’s what lets R&D chemists forge ahead with confidence—knowing the bottle on their bench holds exactly what the label says, produced by specialists who treat each batch as a living link in the research chain.
Nobody stays complacent. Our plant’s success with benzhydryl isothiocyanate reflects a combination of technical tradition and continual learning, informed at every turn by the outcomes and feedback of the people who depend on clean, dependable chemicals for tomorrow’s breakthroughs.