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HS Code |
382337 |
| Chemicalname | 3-Nitrophenyl Isothiocyanate |
| Casnumber | 1900-59-8 |
| Molecularformula | C7H4N2O2S |
| Molarmass | 180.19 g/mol |
| Appearance | Yellow to orange crystalline powder |
| Meltingpoint | 76-78°C |
| Density | 1.41 g/cm³ |
| Solubility | Slightly soluble in water, soluble in organic solvents |
| Storagetemperature | Store at 2-8°C |
| Purity | Typically ≥98% |
| Synonyms | m-Nitrophenyl isothiocyanate |
| Ecnumber | 217-366-9 |
| Smiles | C1=CC(=CC(=C1)N=C=S)[N+](=O)[O-] |
| Inchikey | GSVXEQQVKLHTLQ-UHFFFAOYSA-N |
As an accredited 3-Nitrophenyl Isothiocyanate factory, we enforce strict quality protocols—every batch undergoes rigorous testing to ensure consistent efficacy and safety standards.
| Packing | 3-Nitrophenyl Isothiocyanate, 5g: Supplied in an amber glass bottle with screw cap, labeled with chemical name, hazard symbols, and batch information. |
| Shipping | 3-Nitrophenyl Isothiocyanate is shipped in tightly sealed containers, protected from moisture, light, and heat. It is handled as a hazardous material and packed according to international regulations for chemicals, typically using UN-approved packaging. Transport documentation includes safety data and hazard classification to ensure safe and compliant delivery. |
| Storage | 3-Nitrophenyl Isothiocyanate should be stored in a cool, dry, and well-ventilated area, away from light and sources of ignition. Keep the container tightly sealed and store away from incompatible substances such as strong oxidizers and acids. Recommended storage temperature is 2–8°C. Ensure proper labeling and secondary containment to prevent leaks or spills. Use appropriate personal protective equipment when handling. |
Applications of 3-Nitrophenyl Isothiocyanate in Industrial Manufacturing3-Nitrophenyl Isothiocyanate is an essential reagent widely utilized in advanced segments of the chemical, pharmaceutical, and analytical industries. The following sections detail its established roles in specific downstream sectors, with data reflecting real operational standards, formulation ranges, process inclusion points, and typical final goods encountered by professionals using this raw material at scale. 1. Peptide and Protein Sequencing by Edman DegradationAnalytical laboratories and specialized biotech manufacturers apply this reagent during the Edman degradation cycle for protein and peptide N-terminal sequencing. Its nitro-substituted structure provides increased sensitivity for UV detection, facilitating precise automation in amino acid analysis platforms. This application demands stringent adherence to laboratory standards and integration directly in automated sequencers. Industry compliance standards
Typical usage ratio
Downstream process integration
Final product types
2. Pharmaceutical Intermediate Synthesis (Active Compound Development)Process chemists in API development select this isothiocyanate for introducing isothiocyanate groups during heterocyclic compound synthesis, particularly for molecules designed as kinase inhibitors, specialty antivirals, or enzyme modulator classes. The nitro group modulates electron distribution, supporting regioselective functionalization under controlled conditions. Industry compliance standards
Typical usage ratio
Downstream process integration
Final product types
3. Chromatographic Derivatization Reagent ProductionCompanies manufacturing HPLC or capillary electrophoresis kits use the material for derivatizing amino acids, short peptides, and specific nucleophiles, enhancing chromatogram resolution and detection accuracy. The nitro-functionalized reagent produces derivatives with strong UV absorbance, aligning with advances in detectable labeling and trace analysis workflows for quality assurance or forensic labs. Industry compliance standards
Typical usage ratio
Downstream process integration
Final product types
4. Fine Chemical Building Block for Specialty Agrochemical R&DResearch divisions in crop protection innovation employ this compound for synthesizing isothiocyanate-functionalized intermediates, vital in the structure-modification of selective herbicides and nematicides. Its electron-withdrawing properties permit targeted incorporation into aromatic backbones during lead optimization studies, followed by scaling for pilot toxicology evaluation batches. Industry compliance standards
Typical usage ratio
Downstream process integration
Final product types
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Today, let’s talk about a compound that has earned its place in laboratories across the globe: 3-Nitrophenyl Isothiocyanate. As the team engaged from the start—raw material, synthesis, purification, all the way to packaging—there is a responsibility to explain what makes this compound work as well as it does, and why clients keep seeking it for research and industrial needs.
Our experience with 3-Nitrophenyl Isothiocyanate (CAS 22942-07-8, molecular formula C7H4N2O2S) goes back decades. This compound isn’t a one-size-fits-all product tossed off an assembly line. Every batch tells a story of raw material quality, handling discipline, temperature control, and—most importantly—an awareness of how even minor impurities or variations can throw off a research protocol or an entire production cycle.
Chemists in the field know that even a well-synthesized compound can pose headaches if contamination or repeat variance shows up. Each batch of our 3-Nitrophenyl Isothiocyanate gets high-performance liquid chromatography (HPLC) profiling and melting point confirmation. Most orders demand purity above 98%. Results show that proper solvent selection during final wash phases directly cuts down on trace aromatic residues and sulfur byproducts.
Some clients have shared stories: batches from inconsistent origins led to inconclusive assays or ghost peaks during spectrometric analysis. Delivering 3-Nitrophenyl Isothiocyanate that keeps clean spectra means we stick with a strict line of intermediates and reactants, monitored in-house. Day in and day out, research institutions or pharmaceutical labs ask for analytical documentation, chromatograms, and retention time data because mistakes in the lab bench cost time and credibility.
This molecule’s signature – the combination of nitro and isothiocyanate groups on a phenyl ring – draws demand for solid-phase peptide synthesis (SPPS), derivatization in chromatographic amino acid analysis, and various custom research projects. Let’s break that down based on what R&D departments actually do.
For peptide mapping, 3-Nitrophenyl Isothiocyanate attaches to terminal amine groups, creating stable derivatives. Technicians need reproducible reactivity. If substituent positions or impurities shift, the chromatographic retention times wander, making quantitation shaky. That’s why we use controlled temperature cycling for isothiocyanation steps, leading to predictable reactivity from batch to batch.
Biochemists examining protein sequencing processes often complain when isothiocyanate reagents decompose from moisture absorption or air exposure. Experience taught us that moisture control right through to the packaging room makes more difference than any post-shipment stabilization. This is the lived edge in the manufacturing process. Each moisture-tight amber bottle, purged with inert nitrogen, limits product changes beyond the warehouse, removing headaches once the bottle lands bench-side in New York or Shanghai.
Outside protein chemistry, some teams call on this molecule for synthetic intermediates in pharmaceuticals and agrochemical development. Here, selectivity becomes a selling point. The nitro group at the meta-position gives sharper electron density, which translates to more predictable reactions during nucleophilic substitution. Counterparts like 4-Nitrophenyl Isothiocyanate do not offer the same well-behaved profile in certain formation reactions—a point that chemists running screens appreciate when troubleshooting a stubborn step.
Many researchers compare 3-Nitrophenyl Isothiocyanate with phenyl isothiocyanate or 2-nitro analogs. Subtle differences in physical properties become critical. The ortho version can suffer from steric interference; para tends to give less sensitivity for chromophore detection. The 3-nitro arrangement produces cleaner derivatization by limiting side-chain interference, proven on many HPLC and LC-MS systems in peer-reviewed studies. Analytical chemists respect that a reliable peak gives unambiguous data at the end of a twelve-hour run.
Anyone who’s ever run a kilo-scale reaction of aryl isothiocyanate knows the perils of exotherm control. We’ve engineered batch kettles for even cooling and continuous agitation, so spot overheating (or cold spots) won’t damage sensitive intermediates. Early on, lesson was learned: poor pH monitoring during reaction quenching can lead to loss of yield and too many tars in the mother liquor. Adjustments ensured every batch gets pilot-tested before mainstream run; no academic paper or theoretical shortcut substitutes for hands-in-the-mix experience on the shop floor.
Filtered product works better than product quickly thrown through a basic mesh. Minute solid impurities settle as haze even when HPLC says purity crosses the threshold. Chromatography columns clog; instrument downtime follows. We devote time to repeated filtration and use calibrated particle sizers, so each package brings less risk. It is not only a matter of numbers—it’s the outcome of learning what brings phone calls back and what drives customers away.
Every response from a research scientist that says, “Your product let me pinpoint low-level peptides with no drift,” speaks louder than any spec sheet. Teams on the production floor remember these bits of feedback at every shift meeting.
Some in the market argue that any isothiocyanate will do for basic derivatization work. But not every variant serves advanced protocols. The 3-nitro configuration creates a unique electron distribution; it reacts with amines to form urea-linked derivatives with high UV absorption, perfect for tracking with straightforward detection systems. If you rely on older phenyl isothiocyanate derivatives, results can be lower in yield and tougher to interpret. The 3-nitro substitution avoids off-target labeling, especially useful when tracking low-abundance species in biological samples.
There’s talk about cost savings with cheaper, off-grade materials. Price always enters the conversation, but in our experience with pharma and life sciences, quality trumps small savings. Failed syntheses and questionable results chew up money. As a manufacturer, we hear the impact on inventory turns and project timelines—saving a few percent on starting material means nothing if it drags timelines by a week.
Research divisions at multinational drug companies sometimes need gram lots for pilot studies; stages progress, and procurement jumps to kilo-quantities or more for preclinical batches. Each scale comes with different problems. Scaling up the synthesis from pilot to production uncovered issues nobody predicted in early lab notes: cooling time underestimated, solvent recovery system insufficient, filtration clog that risked a whole batch.
We adjusted by separating pilot and production suites, complete with their own fume management and waste handling systems. This change improved the yield during scale-up and kept regulatory inspectors happy on unannounced visits. Small volumes for academic or start-up use get matched with flexible packaging, while contract customers demand technical traceability—batch chromatograms and historical performance summaries included with each delivery.
People working every day with 3-Nitrophenyl Isothiocyanate confront issues often glossed over in sales literature. This compound will irritate skin, eyes, and mucous membranes right out of the bottle. Few talk about the raw edge of vapor exposure; we make sure employees work under captured hoods, wearing nitrile gloves and splash-resistant goggles at every step from synthesis to filling.
We’ve taken an active approach to solvent recycling in the isothiocyanation phase, reclaiming aromatic solvents from waste storage. It isn’t just about cost—tightening up recycling targets means less atmospheric venting, lower emissions paperwork, and a safer environment for on-shift personnel. We continue research with a local university group on greener methods, exploring less toxic alternatives that cut down on dangerous byproducts in aqueous waste.
End-users often ask about storage conditions and shelf life. Since the isothiocyanate group reacts with water vapor in air, we ship in airtight bottles with desiccant packs. Stories come back from customers running time-course studies: product stored in humid rooms decayed within weeks, throwing off reproducibility. Our bottles ship in moisture-guard cartons with humidity indicators, offering additional feedback for busy labs.
People often underestimate the frustration that can arise when technical troubleshooting leads nowhere. Every shipment leaves with direct line access to technical staff on both the manufacturing and R&D side. No salesman shields, no endless phone queues—end users correspond with the chemists who made the compound, not just order handlers. Requests for documentation or guidance on specific derivatization are fielded around the clock. This ongoing service has made for long-term collaborations, not just one-off orders.
Troubleshooting often reveals process differences, not just product variables. For example, customers have reported peak broadening in HPLC trace—even when product purity meets the mark. Sharing experience, we’ve seen that small changes in injection solvent or column temperature cause these results. Instead of responding with a generic “meets spec” answer, our staff work side by side, often re-creating their protocols and solving the root issue. Dedicated chemists make for serious advantage, because only the people who made the batch can translate the nuances of its behavior.
Often, large distributors or resellers don’t understand the chemistry of what they’re selling. When someone picks up the phone or emails us directly, concerns about consignment age, potential degradation, or minor batch differences can be addressed without scripted replies. Real field data, season-by-season, informs shipping and packaging changes, not just quarterly cost calculations.
In the synthetic chemistry of amino acids or small peptides, phenyl isothiocyanates have been the standard. The industry long relied on 4-nitro and unsubstituted phenyl variants. Collecting feedback and reviewing application literature, the 3-nitro substituted version shows better selectivity, both in the ease of derivatization and the crystallinity of the final urea product.
Researchers noticed that the ortho nitro compound, with the nitro group at the 2-position, causes steric hindrance, reducing access to amine groups. Para-substituted isothiocyanates, while easier to make, lack the strong electron-withdrawing effect needed for high-reactivity derivatization, which means researchers get lower sensitivity or stray byproducts. The 3-nitro isomer often provides more robust yields and higher signal clarity for UV-detection protocols, which gets double-checked each month in our in-house application lab.
Some customers tested our material against European and Japanese competitors. Reports say batches sourced from traders delivered unpredictable side product content, leading to service tickets and lost experiments. In contrast, chemists buying direct from a stable, vertically integrated manufacturer—who synthesizes and analyzes each lot—rarely report such problems.
Our team revises processes based on facts and user feedback. We’ve responded to application chemists who needed more granular impurity data. Instead of offering stripped-down certificates, we upgraded our analytics to include extended impurity profiles. Customers with FDA and EMA-regulated projects get more confidence. For those new to this chemistry, our team schedules technical walkthroughs before first trial runs, reducing lost time and unnecessary error.
The synthesis of 3-Nitrophenyl Isothiocyanate is a field of constant adjustment. Minor changes in starting material quality, batch temperature swings, or storage conditions all affect the final result. Our hands-on team knows that controlling these variables—sourcing raw nitrochlorobenzene from validated sources, tuning reagent addition, monitoring air quality in drying rooms—makes a difference customers feel in every analytical report.
Service, adaptability, and deep familiarity with the compound’s quirks are part of our culture. Regulatory audits, evolving solvent standards, and greener process reviews keep the manufacturing team on watch. We recognize that each new partnership brings yet another use-case or challenge, and each one feeds back into continuous improvement.
3-Nitrophenyl Isothiocyanate is more than a line on a catalog or an anonymous chemical identifier. It’s a complex synthetic challenge, a quality commitment, and a product shaped as much by the diligence of production as by the needs of scientists in the field. Having spent years at the benches and reactors crafting this molecule, we know all too well that users demand more than just specs—they seek reliability, transparency, and partnership from the genuine makers.
Every vial represents hard-won lessons and a readiness to engage directly with those who push the boundaries of synthetic chemistry, life sciences, and new technology. Ongoing investment in analytical equipment, staff training, and greener chemistry ensures 3-Nitrophenyl Isothiocyanate reaches you at a level fit for cutting-edge work. That’s something no reseller or distant trader can replicate.