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2,2,2-Trifluoro-1-(4-(4,4,5,5-Tetramethyl-1,3,2-Dioxaborolan-2-Yl)-5,6-Dihydropyridin-1(2H)-Yl)Ethanone CAS NO 878805-74-4
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CAS No.:878805-74-4
Grade:Pharmacy Grade
Content:99.9%
Brand:Customizable
Packaging:Customizable
Description
2,2,2-Trifluoro-1-(4-(4,4,5,5-Tetramethyl-1,3,2-Dioxaborolan-2-Yl)-5,6-Dihydropyridin-1(2H)-Yl)Ethanone is a high-value, advanced pharmaceutical intermediate featuring a protected boronic ester functional group. This compound is critical for enabling Suzuki-Miyaura cross-coupling reactions, a cornerstone methodology for constructing complex carbon-carbon bonds in medicinal chemistry. It is primarily sought after by pharmaceutical R&D and fine chemical synthesis teams for the development of novel active pharmaceutical ingredients (APIs) and agrochemicals.
Application
- Pharmaceutical Intermediate: Key building block for synthesizing complex drug candidates, particularly those requiring fluorinated or heterocyclic motifs.
- Suzuki-Miyaura Cross-Coupling Reagent: Used as a boronic ester coupling partner to introduce the dihydropyridine moiety into target molecules under mild conditions.
- Agrochemical Research: Intermediate in the development of new herbicides, fungicides, and insecticides with enhanced efficacy.
- Material Science Precursor: Serves as a starting material for creating organic electronic materials and liquid crystals.
- Chemical Biology Probes: Utilized in the synthesis of labeled compounds for target identification and binding studies.
- Academic & Contract Research: Essential reagent for methodology development and complex molecule synthesis in research laboratories.
Basic Information
| Product Name | 2,2,2-Trifluoro-1-(4-(4,4,5,5-Tetramethyl-1,3,2-Dioxaborolan-2-Yl)-5,6-Dihydropyridin-1(2H)-Yl)Ethanone |
| CAS No. | 878805-74-4 |
| Molecular Formula | C15H21BF3NO3 |
| Molecular Weight | 331.14 g/mol |
| Synonyms | 1-[4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)-3,6-dihydro-2H-pyridin-1-yl]-2,2,2-trifluoroethanone; 2,2,2-Trifluoro-1-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,2,3,6-tetrahydropyridin-1-yl]ethanone; 1-(4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)-5,6-dihydropyridin-1(2H)-yl)-2,2,2-trifluoroethanone; 4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)-1-(2,2,2-trifluoroacetyl)-1,2,3,6-tetrahydropyridine; Trifluoroacetyl-protected Dihydropyridine Boronic Ester Pinacol Ester. |
| EINECS | Contact for details |
Quality Control
Every batch of this advanced intermediate is produced under strict quality management systems. We employ advanced analytical techniques including HPLC, NMR (1H, 13C, 19F, 11B), and GC-MS to ensure identity, purity, and consistency. A comprehensive Certificate of Analysis (COA) detailing purity (typically >95% by HPLC), assay, and impurity profile is provided with each shipment to support your regulatory and R&D documentation.
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) for long-term stability. The compound is moisture-sensitive and should be handled in a dry environment. Allow the sealed container to reach room temperature before opening to prevent condensation.
Specification
| Item | Specification |
|---|---|
| Appearance | White to off-white solid |
| Identification (HPLC) | Conforms to reference standard |
| Identification (NMR) | Conforms to structure |
| Purity (HPLC) | ≥ 95% |
| Assay (NMR) | ≥ 97% |
| 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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