925672-89-5

Basic information

• Product Name: 4-BROMO-2-CYANOBENZENEACETONITRILE
• Synonyms: 5-bromo-2-(cyanomethyl)benzonitrile;4-BROMO-2-CYANOBENZENEACETONITRILE
• CAS NO: 925672-89-5
• Molecular Formula: C₉H₅BrN₂
• Molecular Weight: 221.06
• Mol File: 925672-89-5.mol

Chemical Properties

• Boiling Point: 334.583°C at 760 mmHg
• Flash Point: 156.15°C
• Appearance: /
• Density: 1.583g/cm³
• Vapor Pressure: 0mmHg at 25°C
• Refractive Index: 1.607
• Storage Temp.: Sealed in dry,Room Temperature
• CAS DataBase Reference: 4-BROMO-2-CYANOBENZENEACETONITRILE(CAS DataBase Reference)
• NIST Chemistry Reference: 4-BROMO-2-CYANOBENZENEACETONITRILE(925672-89-5)
• EPA Substance Registry System: 4-BROMO-2-CYANOBENZENEACETONITRILE(925672-89-5)

Safety Data

• Hazardous Substances Data: 925672-89-5(Hazardous Substances Data)

Usage

Uses

Used in Pharmaceutical Industry:
4-Bromo-2-Cyanobenzeneacetonitrile is used as a key intermediate for the synthesis of various pharmaceuticals. Its unique molecular structure allows it to be a building block in the development of new drugs, contributing to the advancement of medicinal chemistry.
Used in Agrochemical Industry:
In the agrochemical sector, 4-Bromo-2-Cyanobenzeneacetonitrile is utilized as an essential component in the production of agrochemicals. It aids in the creation of effective pesticides and other agricultural chemicals, enhancing crop protection and yield.
Used in Organic Synthesis:
4-Bromo-2-Cyanobenzeneacetonitrile is employed as a vital building block in organic synthesis. Its presence in the synthesis process enables the production of a wide range of organic compounds, further expanding the scope of chemical research and development.
Proper Handling and Storage:
Due to its classification as a hazardous substance, 4-Bromo-2-Cyanobenzeneacetonitrile requires specific measures for safe handling and storage. This includes adherence to safety protocols, usage of appropriate protective equipment, and secure storage conditions to prevent any potential risks to health and the environment.

InChI:InChI=1/C9H5BrN2/c10-9-2-1-7(3-4-11)8(5-9)6-12/h1-2,5H,3H2

Upstream product

• 179897-89-3 5-Bromo-2-fluoro-benzonitrile 
• 105-34-0 methyl 2-cyanoacetate 

Downstream Products

• 925672-86-2 C₉H₆Br₂N₂ 
• 1033330-27-6 7-bromoisoquinoline-1,3(2H,4H)-dione 
• 4456-77-3 4H-isoquinolin-1,3-dione 

Relevant articles and documents

FUSED-GLUTARIMIDE CRBN LIGANDS AND USES THEREOF

The present invention provides compounds, compositions thereof, and methods of using the same. The present invention also relates to compounds and methods useful for binding and modulating the activity of cereblon (CRBN), especially for the inhibition of CRBN, and the treatment of CRBN-mediated disorders.

Nickel-Catalyzed Tandem Reaction of Functionalized Arylacetonitriles with Arylboronic Acids in 2-MeTHF: Eco-Friendly Synthesis of Aminoisoquinolines and Isoquinolones

The first example of the nickel-catalyzed tandem addition/cyclization of 2-(cyanomethyl)benzonitriles with arylboronic acids in 2-MeTHF has been developed, which provides the facile synthesis of aminoisoquinolines with good functional group tolerance under mild conditions. This chemistry has also been successfully applied to the synthesis of isoquinolones by the tandem reaction of methyl 2-(cyanomethyl)benzoates with arylboronic acids. The use of the bio-based and green solvent 2-MeTHF as the reaction medium makes the synthesis process environmentally benign. The synthetic utility of this chemistry is also indicated by the synthesis of biologically active molecules.

An efficient synthesis of 1,6- and 1,7-dibromo-3-aminoisoquinolines: versatile templates for the preparation of functionalized isoquinolines

An efficient synthetic route to 1,6- and 1,7-dibromo-3-aminoisoquinoline was devised. These intermediates served as ideal templates for the preparation of 3-aminoisoquinoline analogues functionalized at C(6) or C(7).