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1-(2,5-Dimethoxyphenyl)-3-[3-(Tetramethyl-1,3,2-Dioxaborolan-2-Yl)Phenyl]Urea CAS NO 2096997-11-2
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CAS No.:2096997-11-2
Grade:Pharmacy Grade
Content:99.9%
Brand:Customizable
Packaging:Customizable
Description
1-(2,5-Dimethoxyphenyl)-3-[3-(Tetramethyl-1,3,2-Dioxaborolan-2-Yl)Phenyl]Urea is a high-value, functionalized urea derivative containing a boronic ester pinacol group, making it a critical intermediate in modern synthetic chemistry. This compound matters for its dual functionality, serving as a versatile building block for constructing complex molecules via Suzuki-Miyaura cross-coupling reactions and other boron-mediated transformations. Pharmaceutical, agrochemical, and advanced materials researchers need this chemical for developing new active ingredients, functional polymers, and chemical probes, where precise molecular architecture is paramount.
Application
- Pharmaceutical Intermediate: Key building block in the synthesis of novel drug candidates, particularly in kinase inhibitor and protease inhibitor research.
- Agrochemical Development: Used to create new active ingredients for crop protection products through structure-activity relationship (SAR) studies.
- Material Science: Serves as a monomer or cross-linking agent in the development of boron-containing polymers and advanced organic frameworks.
- Chemical Biology & Proteomics: Utilized in the design of activity-based probes (ABPs) and affinity reagents targeting specific enzymes or proteins.
- Suzuki-Miyaura Cross-Coupling: The tetramethyl-1,3,2-dioxaborolan-2-yl (pinacol boronic ester) group enables efficient palladium-catalyzed carbon-carbon bond formation.
- Library Synthesis: A valuable scaffold for generating diverse compound libraries in high-throughput screening for drug discovery.
Basic Information
| Product Name | 1-(2,5-Dimethoxyphenyl)-3-[3-(Tetramethyl-1,3,2-Dioxaborolan-2-Yl)Phenyl]Urea |
| CAS No. | 2096997-11-2 |
| Molecular Formula | C21H27BN2O5 |
| Molecular Weight | 398.26 g/mol |
| Synonyms | 3-(3-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)-1-(2,5-dimethoxyphenyl)urea; 1-(2,5-Dimethoxyphenyl)-3-(3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)urea; Urea, N-(2,5-dimethoxyphenyl)-N'-[3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-; Boric acid, cyclic ester with N-(2,5-dimethoxyphenyl)-N'-(3-hydroxyphenyl)urea; Boronic ester urea derivative CAS 2096997-11-2 |
| EINECS | Contact for details |
Quality Control
Our production of 1-(2,5-Dimethoxyphenyl)-3-[3-(Tetramethyl-1,3,2-Dioxaborolan-2-Yl)Phenyl]Urea adheres to stringent quality protocols to ensure batch-to-batch consistency and high purity for research and development applications. Each lot is characterized by advanced analytical techniques including HPLC, NMR, and LC-MS. A comprehensive Certificate of Analysis (COA) detailing identity, purity, and impurity profiles is provided with every shipment to support your regulatory and quality documentation needs.
Storage
Preserve in a tightly closed container, protected from light. Store in a cool, dry place at a controlled room temperature (15-25°C). This compound is hygroscopic (moisture-sensitive) and should be handled under anhydrous conditions when possible. For long-term storage, consider storing under an inert atmosphere such as argon or nitrogen to maintain stability.
Specification
| Item | Specification |
|---|---|
| Appearance | White to off-white solid |
| Identification (IR) | Conforms to structure |
| Identification (NMR) | Conforms to structure |
| Purity (HPLC) | ≥ 95.0% |
| Water Content (KF) | ≤ 1.0% |
| Heavy Metals | ≤ 20 ppm |
Note: Specifications can be tailored. Please contact us for the detailed technical data sheet of a specific grade.
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