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HS Code |
764978 |
| Chemical Name | (S)-(-)-1-Phenylethyl Isocyanate |
| Cas Number | 41406-97-9 |
| Molecular Formula | C9H9N |
| Molar Mass | 131.18 g/mol |
| Appearance | Colorless to pale yellow liquid |
| Boiling Point | 93-95 °C (11 mmHg) |
| Density | 1.03 g/mL at 25 °C |
| Refractive Index | 1.565-1.570 |
| Optical Rotation | [α]D20 = -44° (neat) |
| Solubility | Insoluble in water, soluble in organic solvents |
| Flash Point | 85 °C (closed cup) |
| Purity | Typically ≥98% |
As an accredited (S)-(-)-1-Phenylethyl Isocyanate factory, we enforce strict quality protocols—every batch undergoes rigorous testing to ensure consistent efficacy and safety standards.
| Packing | (S)-(-)-1-Phenylethyl Isocyanate is supplied in a tightly sealed amber glass bottle, 5 grams, with hazard labels and product information. |
| Shipping | (S)-(-)-1-Phenylethyl Isocyanate is typically shipped in tightly sealed containers under cool, dry conditions, protected from light and moisture. It is considered a hazardous material and must be handled following appropriate regulations for toxic and reactive chemicals, including labeling, documentation, and, if required, temperature control during transit. |
| Storage | (S)-(-)-1-Phenylethyl Isocyanate should be stored in a tightly sealed container under an inert atmosphere (such as nitrogen), in a cool, dry, and well-ventilated area away from moisture, heat, ignition sources, and incompatible substances like strong acids, bases, and oxidizers. Avoid temperature fluctuations and direct sunlight. Proper personal protective equipment should be used when handling or transferring the compound. |
Applications of (S)-(-)-1-Phenylethyl Isocyanate in Industrial Manufacturing(S)-(-)-1-Phenylethyl Isocyanate offers selective reactivity and stereospecificity that support advanced synthesis and value chain integration in multiple chemical industries. As a direct manufacturer, we focus on critical downstream fields where this isocyanate delivers process efficiency, regulatory compatibility, and high-purity performance. The following industrial scenarios represent key sectors that apply our material under controlled and optimized conditions. 1. Chiral Pharmaceutical Intermediate SynthesisMajor pharmaceutical manufacturers employ this isocyanate in the asymmetric synthesis of APIs and their advanced intermediates. Its enantiopurity supports the preparation of optically active ureas and urethanes—essential in small-molecule drug research and GMP-compliant production. Reactions involving the reagent frequently occur during N-alkylation, amine protection, or chiral auxiliary preparation, allowing reliable stereochemical control. Manufacturers fine-tune conditions to reduce racemization, meet regulatory batch records, and align material documentation for each project’s DMF or CEP filings. Industry compliance standards
Typical usage ratio
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2. Agrochemical Active Ingredient ManufacturingLeading agrochemical producers use (S)-(-)-1-Phenylethyl Isocyanate for selective coupling in the production of stereoselective pesticides and herbicidal actives. The isocyanate’s enantiopurity supports specific reactivity in constructing heterocyclic rings, N-substituted amides, and urea-based crop protection molecules, following regulatory dossiers for European and North American markets. Manufacturers maintain strict process analytics and impurity profiling to comply with both product specifications and residual risk assessments outlined in agrochemical registration dossiers. Industry compliance standards
Typical usage ratio
Downstream process integration
Final product types
3. Specialty Polymer and Polyurethane SynthesisPolymer research labs and performance materials companies incorporate this isocyanate into the formation of optically active polyurethanes as well as custom urea-linked elastomers. Its stereochemical integrity allows end-users to tailor physical properties such as tensile modulus, resilience, and compatibility in adhesives, foams, and specialty films. Industrial operators monitor monomer ratios and curing conditions by in-line FTIR, DSC, or GPC to confirm the expected architecture and avoid residual isocyanate content above regulatory limits for occupational health. Industry compliance standards
Typical usage ratio
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4. Fine Chemical Synthesis for Analytical StandardsTrack-and-trace laboratories and chemical reference standard manufacturers require isocyanates with defined stereochemistry for building library compounds, especially in forensic, environmental, and QC analysis. (S)-(-)-1-Phenylethyl Isocyanate finds controlled use in labeling reactions, derivatization of amines, and production of reference markers with reproducible retention profiles for LC-MS, GC-MS, or chiral chromatography. Downstream labs focus on ultra-high purity, batch-to-batch traceability, and documented analytical validity, with our production supporting multi-level documentation and full supply chain visibility. Industry compliance standards
Typical usage ratio
Downstream process integration
Final product types
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Every batch of (S)-(-)-1-Phenylethyl Isocyanate we put together starts with selecting high-purity chiral precursors and running through carefully monitored steps under nitrogen. In the lab, this compound gives a characteristic clear, slightly yellowish liquid form— for us, that always tells the story of its purity. Throughout our production, we use routinely calibrated chiral HPLC to confirm optical purity. The batch-to-batch consistency builds trust with process chemists who rely on repeatable results. Our team has worked for years with this molecule, mainly serving contract manufacturers and research teams in pharmaceuticals, agrochemicals, and advanced materials.
The isocyanate group, coupled to a chiral (S)-phenylethyl backbone, makes this building block suited for enantioselective synthesis. Anyone who’s worked through asymmetric urea or carbamate formation using racemic isocyanates knows the headaches that emerge— unwanted byproducts, low yields, and close-call separations. With our (S)-(-)-1-Phenylethyl Isocyanate, the fixed configuration sets up stereochemical control in downstream reactions. Chemists chasing single enantiomers in custom peptide analogs or novel urea-based active ingredients reach for this when racemization is not an option.
In our experience, purity and enantiomeric excess alone do not paint the full picture for users. We check for hydrolysis stability, record precise moisture content with Karl Fischer titration, and follow with traces of potential side products by GC-MS. A typical lot reads above 98% purity, but we never send out a shipment unless the chiral excess matches the highest international standards. Some users have tried less controlled alternatives from casual sources but soon found reactions failing from hidden impurities or isocyanate degradation. Our approach involves full NMR, IR for functional group confirmation, and we include detailed certificates that reflect real batch data, not generic templates.
This focus on documentation stems from real events: Several years back, a customer in medicinal chemistry faced erratic results from a prior supplier, only diagnosed by our team using advanced chiral GC. That experience shaped our protocols— no material ships until our own R&D chemists verify the test results, not just a paperwork stamp.
In our production environment, (S)-(-)-1-Phenylethyl Isocyanate stands out for its role in transferring an intact chiral center while also providing a highly reactive isocyanate moiety. Unlike simple phenyl isocyanate or racemic 1-phenylethyl isocyanate, the single-enantiomer format lets teams synthesize compounds where biological activity comes strictly from the S-form product. In pharmaceutical development, this distinction matters— receptors and enzymes interact with a preferred orientation, so the wrong enantiomer risks wasted development time, unwanted side effects, or reduced potency.
During our collaboration with university research groups, we’ve seen them use (S)-(-)-1-Phenylethyl Isocyanate to install urea or carbamate groups onto drug scaffolds like chiral amines or substituted anilines. This enables fast SAR screening while keeping the chiral integrity of the resulting molecules. In contrast, trying to resolve racemic mixtures afterward undercuts efficiency. Teams in organocatalysis or preparing chiral auxiliaries benefit from direct synthetic routes: Isolate, purify, derivatize, and move on— all while holding onto the configuration they need.
Our experience working with isocyanates has taught us that stability and safety in storage cannot be ignored. (S)-(-)-1-Phenylethyl Isocyanate reacts quickly with moisture in the air, generating carbamates and losing potency. Routine users have seen this problem when opening poorly sealed containers, only to find a crust of reaction product at the bottle rim and changed viscosity. We package all orders in moisture-tight, amber glass bottles, sometimes in inert atmospheres, to preserve reactivity as long as possible on client shelves. For larger production runs, we deliver in pre-evacuated containers that can hook up to reactor systems directly under nitrogen, preventing accidental exposure that would wipe out value.
On the bench, chemists notice that the distinct aromatic note and manageable viscosity of this isocyanate makes for easy pipetting and reliable measurement. Since reactivity can be boosted or moderated depending on the base and solvents chosen, teams can adapt conditions to their own substrate: rapid conversion with amines, smooth urea formation with sterically hindered partners, or selective carbamoylation. Compared with more volatile or highly toxic isocyanates, the phenylethyl moiety strikes a practical balance between reactivity and user safety when handled by trained personnel.
As chemistry shifts toward more sustainable and efficient asymmetric synthesis, high-purity chiral isocyanates earn a permanent spot in toolkits. (S)-(-)-1-Phenylethyl Isocyanate turns up in everything from discovery-phase libraries to pilot plant scale-ups. For labs setting up combinatorial arrays, we see this isocyanate accelerate the creation of diverse molecular frameworks that retain enantioselectivity right from the start. Our own R&D team once used it to develop a series of analogs for kinase inhibition studies— the clean, one-pot coupling with various amines delivered a series of new structures fast, shaving weeks off earlier timelines that depended on resolving racemates.
The versatility of (S)-(-)-1-Phenylethyl Isocyanate means our clients draw on it for wholly different chemical purposes. Some run site-specific labeling in polymer research, where the chiral handle introduces both new physical and analytical behaviors. In pesticide candidate screening, the same product supplies a gentle route to chiral ureas free from metal contamination or harsh reagents. Each time, the chirality from the starting material persists.
From scaling a handful of grams to kilogram-level campaigns, we’ve witnessed the realities of solvent selection, reaction rates, and downstream processing. We observed once that minor tweaks— a drier solvent, a slightly cooler reaction— made the difference between smooth isolation and a gummy, irrecoverable byproduct. Our technical support team routinely advises process chemists on fine-tuning parameters to prevent color bodies or polymeric residues. That insight only comes from hands-on production and ongoing feedback loops.
With decades on the manufacturing floor, we’ve seen unexpected challenges: pressure bumps during large-scale additions, reaction exotherms, subtle influence of trace metal contamination, or annoying emulsions during workup. One scale-up revealed a tendency for trace hydrolysis unless users stuck to strictly anhydrous protocols— a detail that’s easy to miss at small scale but costs dearly when it turns up late in development. We help by sharing real datasets and adjustment recommendations, not boilerplate advice.
Users come back to our (S)-(-)-1-Phenylethyl Isocyanate because they know what each bottle will deliver— not just on the day of purchase but six months later. Our history has included supporting projects where supply interruptions from lesser-known vendors caused chaos downstream. After confirming structure, identity, and optical activity via several independent tests, we store reserve samples for every lot and maintain detailed traceability back to raw materials. This depth of accountability has helped solve traceability issues when clients needed retrospective quality verification for regulatory filings.
We often field questions comparing this product to competing chiral isocyanates, such as (R)-(+)-1-Phenylethyl versions or those built on aliphatic scaffolds. The (S)-(-)- enantiomer suits targets where biospecificity within the S-series makes the difference, like chiral drugs or flavor intermediates where the perceived ‘handedness’ shapes outcome. Its aromatic and steric characteristics create distinctive reactivity patterns— neither too sluggish for efficient coupling nor too aggressive to cause site-selectivity problems.
Much of our volume comes from repeat syntheses, but early process development involved years of iteration. We optimized catalyst loading to suppress side reactions, scrutinized every impurity profile, and ran stress tests simulating extended storage and varied shipping temperatures. Our operators learned firsthand that a day’s delay in quenching or a moment’s lapse in oxygen control changed finished product performance. All of these lessons became written SOPs and staff training modules so every batch— whether one kilogram or twenty— reflects that hard-won experience.
We integrate both automated metering and manual checkpoints to catch anomalies in real time. If an IR spectrum flags even a trace of phenyl carbamate impurity, we pull back the entire batch. Each load passes dedicated checks for isocyanate group integrity— not just appearance or odor assessments. By maintaining precise records and layered QC steps, we back up each bottle with directly measured, recent batch data.
In our view, correct packaging is as critical as synthesis itself. Many years ago, we saw chemical yield losses and lab accidents linked to carelessly sealed bottles or non-opaque containers arriving from casual sources. We shifted to custom amber glass with tight, lined seals, filled under nitrogen, and tested for leak resistance during simulated shipping trials. Before the product ever reaches a client, it has traveled through mock shipments, with the seals checked for integrity under varying pressure and temperature shifts.
Upon arrival, repeated user feedback highlights that the liquid is not degraded or polymerized— shelf life projections hold up. We send user guidance on optimum storage, outlining not just temperature, but humidity and repeated opening risks, so even teams new to sensitive isocyanates avoid expected problems. Such tangible feedback is factored into every packaging revision; safety and performance only grow more critical as applications become more advanced and demanding.
Technical support at our factory involves direct dialogue between product designers, bench chemists, and field users. More than one client has shared analytical files when an unexpected result emerged in scale-up, and we troubleshoot together, often by re-running small tests or sharing specialty analysis. We log these as case studies in our internal knowledge base, always keeping proprietary details private, but using aggregate learning to refine product handling and QC.
Our own product improvement program draws on accelerated aging trials, push-to-failure storage runs, and expanded impurity mapping. If a client detects a minor impurity in a downstream process, our QC and R&D teams re-examine retention times and spectral features, confirming cross-contamination is absent. We issue addenda to product reports with full transparency, not hiding findings or minimizing their importance. In an industry where reputational loss travels quickly, such openness proves vital.
We offer detailed technical notes and hands-on demonstrations for teams bringing (S)-(-)-1-Phenylethyl Isocyanate into new projects. Rather than distributing generic handling sheets, we provide practical steps for best results: drybox techniques for repeated pipetting, nitrogen backfilling, and protocol checkpoints to catch any signs of early hydrolysis. Our technical trainers have run live sessions in both English and other major languages, guiding client staff through safe transfer and rapid quenching.
One example: a customer scaling up a combinatorial array on functionalized amines consulted with us on the impact of trace water and byproduct on coupling patterns. We set up parallel test reactions using their substrates, documented the yield outcomes, and fine-tuned storage recommendations, saving the team weeks of troubleshooting. Our philosophy involves getting out ahead of problems so our partners can focus on their own scientific advances.
Our (S)-(-)-1-Phenylethyl Isocyanate appears in compounds registered with regulatory authorities in several countries, and we comply with the record retention and batch documentation requirements for pharmaceutical applications. That means maintaining raw material traceability, strict allergen avoidance, and real records of analytical runs for every batch. No lot is destroyed or released without matching its own hardcopy and digital dataset, locked together with freeze samples retained in climate-controlled archives for retrospective review.
Clients preparing files for IND, DMF, or agrochemical registration consistently praise our willingness to share real data and our documented chain of custody. Late-stage chemistry demands absolute trust in supplier records— a standard that only comes from firsthand manufacturing experience, not third-party trading. We have years of audit history, signed supplier declarations, and well-trained compliance staff who know exactly how quality in chiral isocyanates relates to successful product launches and smooth regulatory reviews.
New developments in green chemistry and biocatalysis are pushing demand for enantioselective building blocks further every year. To keep up, our factory reinvests in more advanced chiral analysis equipment and keeps channels open with front-line researchers. Many of our best process tweaks have come straight from client labs— reports of a persistently troublesome impurity, a new solvent regime, or small but measurable yield boosts from subtle parameter shifts.
We encourage users to share experience, good or challenging, so we can adapt storage advice, recommend alternative routes, or use early alerts to prevent batch failures. Our rollout of extended shelf life protocols, improved temperature logging during shipment, and new semi-automated packaging lines originated from collective field feedback. All improvements return to the next batch of (S)-(-)-1-Phenylethyl Isocyanate shipped out, sharpening the cycle of reliability and discovery.
Working as a direct manufacturer of (S)-(-)-1-Phenylethyl Isocyanate, we combine technical expertise, real-world experience, and lessons learned from years in chiral reagent supply. This focus on quality and practical insight supports chemists who cannot compromise on stereochemical purity, who need reliability from synthesis to application, and who value an honest supply partner ready to face challenges together. Every lot reflects a commitment to transparency, safety, and ongoing partnership from our factory floor to your lab bench.