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Comprehensive Overview of 2-Bromo-6-isocyanopyridine (CAS No. 1313435-40-3): Properties, Applications, and Industry Insights

2-Bromo-6-isocyanopyridine (CAS No. 1313435-40-3) is a high-value heterocyclic compound widely utilized in pharmaceutical and agrochemical research. Its unique molecular structure, featuring a bromine substituent and an isocyanide functional group, makes it a versatile building block for synthesizing complex molecules. This article delves into its physicochemical properties, synthetic routes, and emerging applications while addressing trending topics like green chemistry and AI-driven drug discovery.

The growing demand for pyridine derivatives in medicinal chemistry has propelled interest in 2-Bromo-6-isocyanopyridine. Researchers frequently search for "isocyanopyridine solubility" or "bromopyridine reactivity," reflecting its importance in cross-coupling reactions. Recent studies highlight its role in palladium-catalyzed transformations, a hotspot in catalytic C-H activation methodologies. The compound’s electron-withdrawing nature enhances its utility in constructing N-heterocyclic scaffolds for kinase inhibitors.

From a sustainability perspective, 1313435-40-3 aligns with atom-economical synthesis trends. Laboratories increasingly prioritize "low-waste halogenation" techniques when handling such intermediates. Analytical data reveals its melting point (128–131°C) and NMR spectra (δ 7.8–8.5 ppm for aromatic protons) are critical for quality control, as queried in "2-Bromo-6-isocyanopyridine characterization" searches. Its stability under inert atmospheres makes it suitable for high-throughput screening platforms.

Innovative applications include metal-organic frameworks (MOFs) design, where its isocyano group acts as a linker. The compound’s X-ray crystallography data (CCDC deposition numbers frequently cited) aids in structure-activity relationship studies. Notably, patent analyses show rising use in OLED materials, addressing searches like "isocyanopyridine electronic properties." Regulatory-compliant suppliers now offer GC/MS-certified batches to meet Good Laboratory Practice standards.

Emerging machine learning models predict novel reactions for 2-Bromo-6-isocyanopyridine, correlating with "computational chemistry for pyridines" search trends. Future directions may explore its bioconjugation potential in proteolysis-targeting chimeras (PROTACs), a trending therapeutic modality. Storage recommendations (-20°C under argon) and handling precautions (use of glove boxes) remain top queries among industrial users.

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