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1H-Benzimidazole-1-Carboxylic Acid, 6-Methyl-5-(4,4,5,5-Tetramethyl-1,3,2-Dioxaborolan-2-Yl)-, 1,1-Dimethylethyl Ester CAS NO 631912-39-5
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CAS No.:631912-39-5
Grade:Pharmacy Grade
Content:99.9%
Brand:Customizable
Packaging:Customizable
Description
1H-Benzimidazole-1-Carboxylic Acid, 6-Methyl-5-(4,4,5,5-Tetramethyl-1,3,2-Dioxaborolan-2-Yl)-, 1,1-Dimethylethyl Ester is a high-purity, advanced pharmaceutical intermediate featuring a protected boronic ester functionality. This compound is critical for enabling efficient Suzuki-Miyaura cross-coupling reactions, a cornerstone of modern medicinal chemistry for constructing complex biaryl and heterobiaryl scaffolds. It is primarily utilized by R&D chemists and process development scientists in the pharmaceutical and agrochemical industries for the synthesis of novel active ingredients.
Application
- Pharmaceutical Intermediate: Key building block for the synthesis of potential drug candidates targeting various therapeutic areas.
- Suzuki-Miyaura Cross-Coupling Reagent: Enables the formation of carbon-carbon bonds between aromatic rings, essential for creating diverse chemical libraries.
- Agrochemical Research: Used in the development of new herbicides, fungicides, and insecticides with novel modes of action.
- Material Science: Serves as a precursor for organic electronic materials, such as those used in OLEDs and semiconductors.
- Chemical Biology Probes: Utilized in the creation of tagged molecules for studying biological pathways and protein interactions.
- Process Chemistry: Employed in the scale-up and optimization of synthetic routes for commercial manufacturing.
Basic Information
| Product Name | 1H-Benzimidazole-1-Carboxylic Acid, 6-Methyl-5-(4,4,5,5-Tetramethyl-1,3,2-Dioxaborolan-2-Yl)-, 1,1-Dimethylethyl Ester |
| CAS No. | 631912-39-5 |
| Molecular Formula | C19H27BN2O4 |
| Molecular Weight | 358.24 g/mol |
| Synonyms | tert-Butyl 6-methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-benzo[d]imidazole-1-carboxylate; 1-(tert-Butoxycarbonyl)-6-methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzimidazole; 5-Boronic acid, 1H-benzimidazole-1-carboxylic acid, 6-methyl-, 1,1-dimethylethyl ester, pinacol ester; 6-Methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-benzoimidazole-1-carboxylic acid tert-butyl ester; BOC-Protected 6-Methyl-5-Boronobenzimidazole Pinacol Ester |
| EINECS | Contact for details |
Quality Control
Our 1H-Benzimidazole-1-Carboxylic Acid, 6-Methyl-5-(4,4,5,5-Tetramethyl-1,3,2-Dioxaborolan-2-Yl)-, 1,1-Dimethylethyl Ester is manufactured under strict quality control protocols to ensure batch-to-batch consistency and high purity suitable for sensitive coupling reactions. All products undergo rigorous analytical testing, including HPLC, NMR, and MS, to confirm identity and purity. Certificates of Analysis (COA) detailing all specifications are provided with each shipment.
Storage
Preserve in a tightly closed container, protected from light. Store in a cool, dry place at 2-8°C under an inert atmosphere (e.g., nitrogen or argon) due to its moisture-sensitive and light-sensitive nature. Allow the container to reach room temperature before opening to minimize moisture ingress.
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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