878194-94-6

Basic information

• Product Name: 2-Chloro-3-cyano-4-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)pyridine
• Synonyms: 2-Chloro-3-cyanopyridine-4-boronic Acid Pinacol Ester;2-Chloro-3-cyano-4-pyridinylboronic acid pinacol ester;2-Chloro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)nicotinonitrile;2-chloro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine-3-carbonitrile
• CAS NO: 878194-94-6
• Molecular Formula: C₁₂H₁₄BClN₂O₂
• Molecular Weight: 264.52
• Mol File: 878194-94-6.mol

Chemical Properties

• Melting Point: 100-101℃
• Boiling Point: 410.9°C at 760 mmHg
• Flash Point: 202.3°C
• Appearance: /
• Density: 1.2g/cm³
• Vapor Pressure: 5.81E-07mmHg at 25°C
• Refractive Index: 1.521
• Storage Temp.: ?20°C
• CAS DataBase Reference: 2-Chloro-3-cyano-4-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)pyridine(CAS DataBase Reference)
• NIST Chemistry Reference: 2-Chloro-3-cyano-4-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)pyridine(878194-94-6)
• EPA Substance Registry System: 2-Chloro-3-cyano-4-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)pyridine(878194-94-6)

Safety Data

• Hazard Codes: Xn
• Statements: 22-36/37/38
• Safety Statements: 26-36/37/39
• WGK Germany: 2
• Hazardous Substances Data: 878194-94-6(Hazardous Substances Data)

Usage

Uses

Used in Organic Synthesis:
2-Chloro-3-cyano-4-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)pyridine is used as a synthetic intermediate for the preparation of various complex organic molecules. Its unique structure, including the boronic ester group, pyridine ring, and functional groups, allows for versatile reactions and transformations in the synthesis of target compounds.
Used in Research and Laboratory Settings:
2-Chloro-3-cyano-4-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)pyridine is employed as a research tool in academic and industrial laboratories, where it aids in the exploration of new chemical reactions, the development of novel synthetic methods, and the investigation of the properties and reactivity of organoboron compounds.
Used in the Field of Medicinal Chemistry:
In the pharmaceutical industry, 2-Chloro-3-cyano-4-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)pyridine may be utilized as a building block for the design and synthesis of potential drug candidates, particularly those targeting enzymes or receptors that can be modulated by pyridine-containing molecules. Its reactivity and functional groups can be exploited to create new bioactive molecules with potential therapeutic applications.

InChI:InChI=1/C12H14BClN2O2/c1-11(2)12(3,4)18-13(17-11)9-5-6-16-10(14)8(9)7-15/h5-6H,1-4H3

Upstream product

• 878194-88-8 C₆H₄BClN₂O₂ 
• 76-09-5 2,3-dimethyl-2,3-butane diol 
• 6602-54-6 2-chloro-3-pyridinecarbonitrile 
• 5419-55-6 Triisopropyl borate 

Downstream Products

• 886362-03-4 2-chloro-4-(p-tolyl)nicotinonitrile 
• 1644384-66-6 methyl 4-(2-chloro-3-cyanopyridin-4-yl)benzoate 

Relevant articles and documents

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