852362-22-2

Basic information

• Product Name: 1-BENZYL-1H-PYRAZOLE-4-BORONIC ACID
• Synonyms: AKOS BRN-0254;1-BENZYL-1H-PYRAZOLE-4-BORONIC ACID;1-BENZYL-1H-PYRAZOL-4-YLBORONIC ACID;1-BENZYL-4-1H-PYRAZOLEBORONIC ACID;1H-PYRAZOLE-1-BENZYL-4-BORONIC ACID;1H-Pyrazole-benzyl-4-boronic acid;1-Benzyl-1H-pyrazol-4-boronic acid;1-(Phenylmethyl)-1H-pyrazole-4-boronic acid, 1-Benzyl-4-borono-1H-pyrazole
• CAS NO: 852362-22-2
• Molecular Formula: C10H11BN2O2
• Molecular Weight: 202.02
• Product Categories: Heterocyclic Compounds;Boronic acid;Organoborons;Pyrazole;Boronic Acids;Boronic Acids and Derivatives;Chemical Synthesis;Heteroaryl Boronic Acids;Organometallic Reagents
• Mol File: 852362-22-2.mol
• Article Data: 0

Chemical Properties

• Melting Point: 76-81℃
• Boiling Point: 438.4 °C at 760 mmHg
• Flash Point: 219 °C
• Appearance: White solid
• Density: 1.17
• Vapor Pressure: 1.84E-08mmHg at 25°C
• Refractive Index: 1.579
• Storage Temp.: 2-8°C
• PKA: 7.73±0.10(Predicted)
• CAS DataBase Reference: 1-BENZYL-1H-PYRAZOLE-4-BORONIC ACID(CAS DataBase Reference)
• NIST Chemistry Reference: 1-BENZYL-1H-PYRAZOLE-4-BORONIC ACID(852362-22-2)
• EPA Substance Registry System: 1-BENZYL-1H-PYRAZOLE-4-BORONIC ACID(852362-22-2)

Safety Data

• Hazard Codes: Xi
• WGK Germany: 3
• HazardClass: IRRITANT
• Hazardous Substances Data: 852362-22-2(Hazardous Substances Data)

Usage

Description

1-BENZYL-1H-PYRAZOLE-4-BORONIC ACID is a chemical compound characterized by the molecular formula C12H12BNO2. It is a versatile boronic acid known for its applications in organic synthesis, particularly in the preparation of pharmaceuticals and agrochemicals. 1-BENZYL-1H-PYRAZOLE-4-BORONIC ACID is recognized for its utility in various chemical reactions, including Suzuki-Miyaura coupling and palladium-catalyzed cross-coupling reactions, as well as its potential in the development of fluorescent materials, sensors, and organic light-emitting diodes. Its significance extends to medicinal chemistry, where it plays a role in the design and synthesis of novel drugs with diverse pharmacological activities, making it a valuable asset in chemical research and drug discovery.

Uses

Used in Pharmaceutical and Agrochemical Industries:
1-BENZYL-1H-PYRAZOLE-4-BORONIC ACID is used as a key intermediate in the synthesis of pharmaceuticals and agrochemicals for its ability to facilitate the formation of new carbon-carbon bonds through boronic acid reactions.
Used in Organic Synthesis:
1-BENZYL-1H-PYRAZOLE-4-BORONIC ACID is used as a reagent in organic synthesis for its role in Suzuki-Miyaura coupling and palladium-catalyzed cross-coupling reactions, which are essential for constructing complex organic molecules.
Used in the Development of Fluorescent Materials:
1-BENZYL-1H-PYRAZOLE-4-BORONIC ACID is used as a precursor in the development of fluorescent materials due to its chemical properties that can be harnessed to create compounds with specific light-emitting characteristics.
Used in Sensor Technology:
1-BENZYL-1H-PYRAZOLE-4-BORONIC ACID is used as a component in the design of sensors for its potential to interact with various analytes, leading to the development of sensitive and selective detection methods.
Used in Organic Light-Emitting Diodes (OLEDs):
1-BENZYL-1H-PYRAZOLE-4-BORONIC ACID is used as a material in the fabrication of organic light-emitting diodes, contributing to the advancement of display and lighting technologies.
Used in Medicinal Chemistry:
1-BENZYL-1H-PYRAZOLE-4-BORONIC ACID is used as a building block in medicinal chemistry for the design and synthesis of novel drugs with a range of pharmacological activities, highlighting its importance in drug discovery and development.

InChI:InChI=1/C10H11BN2O2/c14-11(15)10-6-12-13(8-10)7-9-4-2-1-3-5-9/h1-6,8,14-15H,7H2

Downstream Products

• 1435106-90-3 C₂₆H₂₅N₃O₄S₂