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HS Code |
908533 |
| Cas Number | 2526-67-2 |
| Molecular Formula | C7H4N2O3 |
| Molecular Weight | 164.12 |
| Iupac Name | 2,1,3-benzoxadiazole-5-carboxylic acid |
| Appearance | Off-white to light yellow powder |
| Melting Point | 259-262°C |
| Solubility | Slightly soluble in water, soluble in DMSO and methanol |
| Purity | Typically ≥98% |
| Synonyms | 5-Carboxybenzofurazand, 5-Benzofurazancarboxylic acid |
| Boiling Point | Decomposes before boiling |
| Storage Conditions | Store at room temperature, keep dry |
| Smiles | C1=CC2=NC(=NO2)C=C1C(=O)O |
As an accredited 2,1,3-Benzoxadiazole-5-Carboxylic Acid factory, we enforce strict quality protocols—every batch undergoes rigorous testing to ensure consistent efficacy and safety standards.
| Packing | The 25g of 2,1,3-Benzoxadiazole-5-Carboxylic Acid is supplied in a sealed amber glass bottle with a chemical-resistant screw cap. |
| Shipping | 2,1,3-Benzoxadiazole-5-Carboxylic Acid is shipped in tightly sealed containers, protected from moisture and direct sunlight. The packaging complies with relevant chemical transport regulations, ensuring safe handling. It is typically transported as a solid, non-hazardous chemical, with documentation included for identification and safety. Store at room temperature upon arrival. |
| Storage | 2,1,3-Benzoxadiazole-5-Carboxylic Acid should be stored in a tightly sealed container, protected from moisture and direct sunlight. Keep it in a cool, dry, and well-ventilated area, away from incompatible substances such as strong oxidizers. Ensure clear labeling and compliant storage according to local chemical safety regulations. Use proper personal protective equipment when handling the compound. |
Applications of 2,1,3-Benzoxadiazole-5-Carboxylic Acid in Industrial Manufacturing2,1,3-Benzoxadiazole-5-Carboxylic Acid serves as a specialized intermediate used by downstream industries for advanced material functionalization, chromophore extension, and performance property enhancement. Below, we outline its use in the most established application scenarios, with detailed procedural information relevant to industrial manufacturers. 1. Fluorescent Dye and Optical Brightener SynthesisManufacturers in the colorant and performance pigment sector incorporate this compound to synthesize benzoxadiazole-based fluorescent dyes, primarily for textile, polymer, and paper applications requiring high-visibility, UV-activated luminescence, and color fastness. The carboxylic acid functionality enables direct participation in condensation and coupling reactions, facilitating molecular integration into dye structures tailored for absorption and emission maxima in the blue-violet spectrum. Industry compliance standards
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2. Functional Polymer Modification (High-Performance Materials)Polymer manufacturers leverage the structural motif of this compound for the design of functional materials, including polyimides and copolymers aimed at electronics, membrane, and aerospace applications. The benzo[c][1,2,5]oxadiazole core acts as an electron-deficient unit, enabling fine-tuning of thermal, mechanical, and dielectric properties. The carboxylic moiety allows covalent incorporation via co-polymerization or end-group modification, ensuring precise control over molecular architecture and macromolecular chain interactions. Industry compliance standards
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3. Pharmaceutical Intermediate for Active Ingredient SynthesisActive pharmaceutical ingredient (API) manufacturers employ benzoxadiazole-5-carboxylic derivatives in the custom synthesis of heterocyclic scaffolds used in central nervous system (CNS) modulators and kinase inhibitors. The acid group offers a handle for selective amide coupling and esterification, ensuring regioselectivity in stepwise synthetic routes under GMP conditions. This method allows for the scalable production of reference compounds or intermediates subsequently transformed into complex APIs through established organic transformations. Industry compliance standards
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4. Analytical Reagents for Fluorescence-LabelingSpecialty reagent manufacturers use benzoxadiazole-5-carboxylic acid in the production of molecular probes and labeling reagents for protein and small molecule detection, especially in fluorescence-based analytical and diagnostic techniques. The carboxyl function provides conjugation points for covalent coupling to amino, thiol, or hydroxyl functionalities in biomolecules. This allows for the fine-tuning of probe solubility and detection wavelength, with applicability in immunoassays and high-sensitivity chromatography or imaging systems. Industry compliance standards
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Working in chemical manufacturing, you develop a respect for each compound that leaves the reactor. Over the years, 2,1,3-Benzoxadiazole-5-Carboxylic Acid has proven its reliability in specialty chemical production. It's more than just another intermediate. As chemists and process engineers get familiar with heterocyclic chemistry, the benzoxadiazole core stands out. This structure brings stability, rigid aromaticity, and handy functionalization spots. In the lab, batches of 2,1,3-benzoxadiazole-5-carboxylic acid show consistent quality, usually presenting as a pale, crystalline solid. Each prep run delivers a material that holds up under basic purity analysis—HPLC purity comfortably above 98%—offering researchers a clean start for downstream chemistry.
The compound’s model fits the needs of those searching for performance in pharmaceuticals, agrochemical discovery, and fluorescent probes. Its carboxylic acid group allows direct conjugation routes. The benzoxadiazole ring offers photostability and electronic properties valued in dye chemistry, while reliable handling in our plant keeps contamination out of the product. By forming strong hydrogen bonds, this acid provides predictable behavior during crystallization, which makes purification and process scale-up less of a gamble than trendier heterocycles.
From a production standpoint, manufacturing this compound means balancing temperature, solvent ratio, and reaction atmosphere. It doesn’t forgive sloppy technique; run it too hot, and you degrade the product. Scrimp on solvent, and batch yields drop off. Our reactors must handle a series of steps: starting with nitration and cyclization of substituted precursors, then finishing with careful acid hydrolysis. Technicians keep an eye on each phase, sampling as the reaction progresses. Only through experience do you appreciate how quickly premature hydrolysis can ruin an entire kettle. Waste streams need neutralization, and good environmental practice means capturing and recycling solvents whenever possible.
Experienced operators note that the product purifies well with recrystallization from a polar solvent. Some of our competitors choose flash chromatography for early-stage pilot runs, but that method scales poorly, wasting solvent and resin. Over the years, our plant engineers refined our purification steps to reduce energy consumption and solvent loss. Ultimately, equipment must endure rigorous cleaning routines, since even trace contaminants swing analytical results, frustrating synthetic chemists downstream.
In real-world use, this acid enters many projects before the finished molecule lands in an end product. Pharma companies often turn to benzoxadiazole derivatives for lead compound discovery. Medicinal chemists swap out the carboxylic acid for various amides, esters, or even turn that position into bioisosteres, all while preserving the core ring. Having produced tons of this compound, we understand that its reactivity opens possibilities for peptide coupling and click-chemistry applications. Fluorescence researchers trust its photostability and the ease with which it conjugates to biomolecules or polymers; batch-to-batch consistency gives them confidence in their spectral readings.
Agrochemical teams also value the compound when testing new plant-protection agents. Its aromatic, nitrogen-rich backbone often survives harsh soil conditions, so field trials for related molecules don’t fail on the first rain. The compound works as a reliable stepping stone toward more complex, patent-protected derivatives.
Dye and pigment researchers look for electron-deficient platforms to modify absorption and emission spectra—2,1,3-Benzoxadiazole-5-Carboxylic Acid frequently comes up in that toolbox. Everyday experience, batch tracking, and feedback from purchasing and R&D staff have shown that consistency in appearance, melting point (consistently above 200°C), and finished assay gives users a headstart compared to obscure heterocycles that show up in theoretical papers but fizzle in practice.
Hundreds of benzoxadiazole derivatives make their way through R&D screens every year. Speaking as someone who’s handled dozens of related products, subtle differences matter. Some chemists opt for 4- or 7-carboxylic acid isomers for niche reactivity, yet 5-position substitution strikes a practical balance: enough room for diverse coupling agents, no unnecessary strain on the core skeleton, fewer side products during condensation reactions. We see reduced fouling in glassware, faster filtration, and truly manageable workups while isolating the 5-carboxylic acid versus the more strained analogues.
Simple side-by-side analysis in our QC lab reveals that the 2,1,3 configuration gives a combination of stability and reactivity praised by process chemists. We noticed early on that certain customers pushed for higher-purity material, often above 99%. Our plant couldn’t always match that on the 4-carboxylic isomer, since parallel side reactions made isolation tricky. With the 5-substituted version, high-purity lots ship reliably with far less post-processing. This means fewer delays in custom synthesis jobs for downstream users and a faster path to new candidate materials.
Beyond isomerism, many labs consider switching to other heterocycles—triazoles, imidazoles, or even fused bicyclic systems. Our staff has worked up all these classes. Triazoles show excellent stability, but sourcing starting materials can make procurement expensive and slow. Fused aromatics tend to clog up in water-soluble applications, which slows developing robust formulations for biological screening. Over time, we’ve learned that the 2,1,3-benzoxadiazole motif, especially at the 5-carboxylic acid position, meets a sweet spot for both synthetic maneuverability and day-to-day reliability.
On the analytical side, tracking impurities is less of a struggle compared to other nitrogen-rich aromatic acids. We found that side reactions in 2,1,3-benzoxadiazole-5-carboxylic acid synthesis usually result in structurally similar, easily separable byproducts. We keep well-maintained HPLC and LC-MS equipment onsite to keep every lot within spec. Routine melting point checks and NMR signatures confirm structure with every batch.
Lots of our customers run their own wet chemistry, so we get to hear what works and what doesn’t. Research labs testing conjugation reactions seek narrow melting point ranges and want carboxylic acid with minimal hydrate formation. Our product line keeps water content low. Peptide chemistry groups appreciate the acid’s lower solubility in non-polar solvents, which assists in selective precipitation steps. Dyes and probes researchers expect the characteristic fluorescence and enjoy the lack of unpredictable decomposition products, which matters when results need to be repeatable, especially in high-sensitivity techniques like flow cytometry or microarray imaging.
There are always pitfalls. Some users demand ever-finer purity thresholds, so we maintain dialogue with them to tweak our purification trains if necessary. Bioconjugation groups pay close attention to salt content—trace sodium or potassium interferes with subsequent coupling reactions. In recent years, we monitored feedback to optimize our final crystallization and drying steps, making sure residual inorganic content remains below one part per thousand.
As an everyday part of production, safety remains a top concern. The starting materials and solvents cannot be taken lightly—our operators suit up every batch cycle. Waste acid gets neutralized onsite, solvent recovery systems keep environmental impact down, and routine tidy-ups in the facility prevent avoidable incidents. We know that a single error cascades, whether in the worker’s well-being or the downstream performance of the chemical.
Our QA staff inspects each outgoing shipment by hand, never relying solely on automation. Chromatograms, NMR checks, and TLCs form the backbone of every certificate released with the product. Regular audits push us to reconsider steps and keep the process robust. As research applications change, so do purity and handling expectations—what counted as ‘good enough’ five years ago no longer passes muster among the new generation of synthetic chemists. Our customers ask more questions, and the best feedback comes from those with direct hands-on frustrations—these drive real improvements.
Inventory managers demand transparent documentation with every order. As requests for traceability climb, so does our focus on clear batch records, SDS updates, and supply chain tracking. It’s not just about reaching a spec; it’s about trusting each bottle can be opened without surprises.
Looking ahead, downstream markets show that this compound won’t fade quietly into the background. Innovations in organic electronics turn to benzoxadiazole motifs for electron transport layers, and their adaptation in organic semiconductors grows year by year. Modular synthetic methods pave the way for entirely new functional materials. We invest lab time into exploring new palladium-catalyzed couplings and greener acids to expand possibilities for users. Each improvement comes from listening to customers—most breakthroughs trace back to someone in R&D lab needing a better intermediate.
Pharmaceutical discovery programs increasingly rely on small, aromatic acids for water solubility and unique biological profiles. Chemists on the sharp end of drug discovery supplement traditional benzoic acids with more complex heterocycles for metabolic stability. It’s telling that order volumes keep rising from groups building libraries of oxadiazoles for patent filings. Our manufacturing methods have been refined with the demands of scale, regulation, and reproducibility.
Sensors and diagnostics designers come back to the compound thanks to its signature photoactivity and its installation ease on biomolecules. Engineers from our site have worked closely with customers to develop modified purification routines tuned for diagnostic marker manufacturing—often pushing us to remove even minute phosphates or halide traces that might confound analytical outcomes.
Pressure mounts for cleaner synthesis in all chemical industries. Our plant answers this by investing in closed-loop production. Solvent recovery rates now routinely top 85%, sharply reducing fresh solvent purchases. Acid neutralization gets monitored electronically, and data from every batch build guides process tweaks. We minimize energy input by refining reaction conditions. This brings operating costs down and echoes broader moves toward responsible chemistry.
Waste handling policies change, driven by regulations and also ethics. The team at our facility attends workshops and safety trainings focusing on the fine points of benzoxadiazole by-products, evaluating routes to upcycle or properly treat every nonconforming fraction. Working with regulators keeps us nimble and lets us adapt labeling and shipping practices proactively.
Realistically, production isn’t flawless. Each new scale or supply chain hiccup asks something different of us. Batch failures usually point back to inadequate cleaning, impurities in incoming reagents, or sub-par handling during isolation. You learn quickly that staff training is as important as sophisticated reactors. A reliable process builds from careful raw material sourcing—a bad kilo of precursor ripples down the supply chain. Because we control every step, from raw input to final packaging, we can troubleshoot issues and catch deviations before they reach customers.
Cost remains a concern for every buyer. Sourcing high-purity 2,1,3-benzoxadiazole-5-carboxylic acid at reasonable prices takes discipline. Bulk purchasing, process optimization, and waste reduction keep unit costs low for large-volume users. We understand price isn’t everything—cheaper material that causes failed syntheses ultimately costs much more than a slightly higher upfront bill.
Global customers expect shipping to run on time and packaging to hold up to long transit. We triple-seal containers, validate packaging under worst-case climate scenarios, and audit logistics partners for reliability. Chemical manufacturing rewards those who pay attention to the devil in the details.
Manufacturers keeping pace in this field adapt quickly to new standards. Over the years, regulatory frameworks have shifted; our products come with updated documentation to satisfy changing REACH or TSCA requirements. Our R&D teams help customers navigate paperwork for import and export hurdles. Occasionally, we pivot synthesis pathways in response to upstream shortages or shifting legislation—flexibility remains essential.
Trust and reputation don’t grow overnight. Experience shapes our craft, and each improvement—whether in filtration, reagent recycling, or technical service—shows up in our customer’s results. By manufacturing 2,1,3-benzoxadiazole-5-carboxylic acid with care, discipline, and a willingness to adapt, we contribute directly to progress in research, industry, and the pursuit of new knowledge.
When researchers open a fresh bottle in the lab—or when process chemists request another drum for pilot plant scale-up—they see the sum of years of experience. Our team draws on hands-on knowledge, careful attention to feedback, and a commitment to producing quality chemical building blocks that move science forward.