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Benzonitrile, 2-[[3-(4,4,5,5-Tetramethyl-1,3,2-Dioxaborolan-2-Yl)Phenoxy]Methyl]- CAS NO 2246772-09-6
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CAS No.:2246772-09-6
Grade:Pharmacy Grade
Content:99.9%
Brand:Customizable
Packaging:Customizable
Description
Benzonitrile, 2-[[3-(4,4,5,5-Tetramethyl-1,3,2-Dioxaborolan-2-Yl)Phenoxy]Methyl]- is a high-value, functionalized aromatic nitrile containing a pinacol boronate ester group, making it a versatile advanced pharmaceutical intermediate and key building block for modern synthetic chemistry. This compound is specifically engineered for applications in Suzuki-Miyaura cross-coupling reactions, a cornerstone methodology for carbon-carbon bond formation. It is essential for researchers and manufacturers in pharmaceutical development, agrochemical synthesis, and materials science who require reliable, high-purity precursors for constructing complex molecular architectures.
Application
- Pharmaceutical Intermediate: Critical building block for the synthesis of active pharmaceutical ingredients (APIs), especially those containing biaryl or extended aromatic systems.
- Agrochemical Synthesis: Used in the research and production of novel herbicides, fungicides, and insecticides that require specific aromatic frameworks.
- Material Science: Serves as a monomer or precursor for organic electronic materials, such as those used in OLEDs (Organic Light-Emitting Diodes) and semiconductors.
- Chemical Research & Development: An indispensable reagent in medicinal chemistry and process R&D for exploring new chemical entities via palladium-catalyzed cross-coupling.
- Ligand and Catalyst Development: Used to synthesize novel ligands and complex organic molecules for catalytic applications.
- Custom Synthesis & Contract Manufacturing: Supplied to CDMOs (Contract Development and Manufacturing Organizations) for client-specific molecule production.
Basic Information
| Item | Details |
|---|---|
| Product Name | Benzonitrile, 2-[[3-(4,4,5,5-Tetramethyl-1,3,2-Dioxaborolan-2-Yl)Phenoxy]Methyl]- |
| CAS No. | 2246772-09-6 |
| Molecular Formula | C20H22BNO3 |
| Molecular Weight | 335.21 g/mol |
| Synonyms | 2-((3-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)phenoxy)methyl)benzonitrile; (3-(2-Cyanobenzyloxy)phenyl)boronic acid pinacol ester; 2-[[3-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)phenoxy]methyl]benzonitrile; Boronic ester derivative of benzonitrile; Aryl boronate ester intermediate; Suzuki coupling reagent |
| EINECS | Contact for details |
Quality Control
Every batch of Benzonitrile, 2-[[3-(4,4,5,5-Tetramethyl-1,3,2-Dioxaborolan-2-Yl)Phenoxy]Methyl]- is manufactured under strict quality management systems. Our products undergo rigorous analytical testing, including NMR (1H, 13C, 11B), HPLC, and mass spectrometry, to ensure identity, purity, and consistency. A comprehensive Certificate of Analysis (COA) detailing all specifications is provided with each shipment to guarantee compliance with your research or production requirements.
Storage
Preserve in a tightly closed container, protected from light. Store in a cool, dry, and well-ventilated place at a controlled room temperature (15-25°C). Due to its hygroscopic (moisture-sensitive) nature, the container must be kept tightly sealed under an inert atmosphere (e.g., nitrogen or argon) after opening to prevent degradation. Keep away from heat and incompatible materials.
Specification
| Item | Specification |
|---|---|
| Appearance | White to off-white crystalline powder |
| Identification (IR) | Conforms to structure |
| Identification (NMR) | Conforms to structure |
| Purity (HPLC) | ≥ 97.0% |
| Water Content (KF) | ≤ 0.5% |
| Residue on Ignition | ≤ 0.1% |
Note: Specifications can be tailored. Please contact us for the detailed technical data sheet of a specific grade.
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