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1-(3-Methylbutyl)-5-(4,4,5,5-Tetramethyl-1,3,2-Dioxaborolan-2-Yl)-1H-Pyrazole CAS NO 847818-77-3


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CAS No.:847818-77-3

Grade:Pharmacy Grade

Content:99.9%

Brand:Customizable

Packaging:Customizable

Description

1-(3-Methylbutyl)-5-(4,4,5,5-Tetramethyl-1,3,2-Dioxaborolan-2-Yl)-1H-Pyrazole is a high-purity, advanced pharmaceutical intermediate and a versatile organoboron building block. This compound is critical for enabling efficient Suzuki-Miyaura cross-coupling reactions, a cornerstone of modern medicinal chemistry and materials science. It is primarily utilized by research institutions and industrial manufacturers in the pharmaceutical, agrochemical, and advanced materials sectors for the synthesis of complex molecules.

Application

  • Pharmaceutical Intermediate: Key building block for the synthesis of active pharmaceutical ingredients (APIs) and drug candidates, particularly in oncology and CNS research.
  • Agrochemical Synthesis: Used in the development of novel pesticides, herbicides, and fungicides requiring specific pyrazole-based structures.
  • Material Science Research: Serves as a precursor for creating organic electronic materials, such as OLED emitters and charge transport layers.
  • Chemical Biology Probes: Employed in the design and synthesis of molecular probes and inhibitors for target identification and validation studies.
  • Cross-Coupling Reactions: A reliable boron reagent for palladium-catalyzed Suzuki-Miyaura couplings to form carbon-carbon bonds under mild conditions.
  • Custom Synthesis & Contract Manufacturing: Supplied to CDMOs for the production of bespoke compounds and small-molecule libraries.

Basic Information

Product Name 1-(3-Methylbutyl)-5-(4,4,5,5-Tetramethyl-1,3,2-Dioxaborolan-2-Yl)-1H-Pyrazole
CAS No. 847818-77-3
Molecular Formula C14H25BN2O2
Molecular Weight 264.18 g/mol
Synonyms 5-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)-1-(3-methylbutyl)-1H-pyrazole; 1-Isoamyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole; 1-(3-Methylbutyl)-5-(tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole; 847818-77-3; Pyrazole boronic acid pinacol ester derivative
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Quality Control

Our 1-(3-Methylbutyl)-5-(4,4,5,5-Tetramethyl-1,3,2-Dioxaborolan-2-Yl)-1H-Pyrazole is manufactured under strict quality management systems. Every batch undergoes rigorous analytical testing, including HPLC, NMR, and GC-MS, to ensure identity, purity, and consistency. Certificates of Analysis (COA) with detailed specifications are provided to guarantee compliance with your research and 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 (typically 15-25°C). This compound is moisture-sensitive; keep the container tightly sealed under an inert atmosphere (e.g., nitrogen or argon) for long-term storage to maintain optimal stability and purity.

Specification

Item Specification
Appearance White to off-white crystalline powder
Identification (HPLC) Conforms
Identification (NMR) Conforms
Assay (HPLC) ≥97.0%
Water Content (KF) ≤0.5%
Residual Solvents (GC) Meets ICH guidelines

Note: Specifications can be tailored. Please contact us for the detailed technical data sheet of a specific grade.

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