99911-10-1

Basic information

• Product Name: 2-(2-cyanopropan-2-yl)benzonitrile
• Synonyms: 2-(2-cyanopropan-2-yl)benzonitrile
• CAS NO: 99911-10-1
• Molecular Weight: 170.214
• Mol File: 99911-10-1.mol
• Article Data: 3

Chemical Properties

• CAS DataBase Reference: 2-(2-cyanopropan-2-yl)benzonitrile(CAS DataBase Reference)
• NIST Chemistry Reference: 2-(2-cyanopropan-2-yl)benzonitrile(99911-10-1)
• EPA Substance Registry System: 2-(2-cyanopropan-2-yl)benzonitrile(99911-10-1)

Safety Data

• Hazardous Substances Data: 99911-10-1(Hazardous Substances Data)

Usage

Appearance

White to light yellow solid, which describes the physical appearance of the compound.

Uses

Mainly used in the production of pharmaceuticals and organic synthesis, which indicates the compound's applications in the industry.

Functional group

Nitrile, which means it contains a carbon-triple bond nitrogen functional group, this gives information about the compound's chemical structure and reactivity.

Solubility

Insoluble in water, but soluble in organic solvents, which indicates the compound's solubility properties.

Boiling point

Relatively high boiling point, which gives an idea of the compound's physical properties.

Hazardous

Can be hazardous if not handled properly, which indicates the need for caution and proper handling of the compound.

Safety regulations

Should be stored and used with caution according to safety regulations, which emphasizes the importance of following proper safety procedures when handling the compound.

Upstream product

• 3759-28-2 (2-cyanophenyl)acetonitrile 
• 74-88-4 methyl iodide 

Downstream Products

• 14576-22-8 7-amino-4,4-dimethyl-2H,4H-isoquinoline-1,3-dione 
• 99911-28-1 7-amino-4,4-dimethyl-8-nitro-2H,4H-isoquinoline-1,3-dione 
• 452296-25-2 2-(2-chloro-phenylamino)-6,6-dimethyl-1,6-dihydro-imidazo[4,5-h]isoquinoline-7,9-dione 
• 1026844-32-5 2-(2-chloro-phenylamino)-7-hydroxy-6,6-dimethyl-1,6,7,8-tetrahydro-imidazo[4,5-h]isoquinolin-9-one 
• 333455-06-4 2-(2,6-Dichlorophenylamino)-6,6-dimethyl-1H,6H-imidazo[4,5-h]isoquinoline-7,9-dione 
• 333458-25-6 2-(2,6-dichloro-phenylamino)-7-hydroxy-6,6-dimethyl-1,6,7,8-tetrahydro-imidazo[4,5-h]isoquinolin-9-one 
• 333455-11-1 2-(2,6-Dichlorophenylamino)-6,7-dimethyl-1,8-dihydro-imidazo[4,5-h]isoquinoline-9-one 
• 1026277-31-5 1-(8-amino-4,4-dimethyl-1,3-dioxo-1,2,3,4-tetrahydro-isoquinolin-7-yl)-3-(4-chloro-phenyl)-thiourea 
• 5488-36-8 4,4-dimethyl-4H-isoquinoline-1,3-dione 
• 100510-65-4 6-Amino-3,3-dimethylindolin-2-one 
• 100510-64-3 1,3-Dihydro-3,3-dimethyl-6-nitro-2H-indol-2-one 
• 1026910-04-2 1-(8-amino-4,4-dimethyl-1,3-dioxo-1,2,3,4-tetrahydro-isoquinolin-7-yl)-3-(2,3,5,6-tetrachloro-phenyl)-thiourea 

Relevant articles and documents

Pyrazolopyrimidine compounds and preparation method thereof, and applications in preparation of anti-cancer drugs

The invention provides a class of pyrazolopyrimidine compounds represented by a formula (I) or pharmaceutically acceptable salts thereof, and a preparation method thereof, and applications of the pyrazolopyrimidine compounds or the pharmaceutically accept

Discovery of 2-phenylamino-imidazo[4,5-h]isoquinolin-9-ones: A new class of inhibitors of lck kinase

An imidazo[4,5-h]isoquinolin-7,9-dione (1) was identified as an adenosine 5′-triphosphate competitive inhibitor of lck by high throughput screening. Initial structure-activity relationship studies identified the dichlorophenyl ring and the imide NH as important pharmacophores. A binding model was constructed to understand how 1 binds to a related kinase, hck. These results suggested that removing the gem-dimethyl group and flattening the ring would enhance activity. This was realized by converting 1 to the imidazo[4,5-h]isoquinolin-9-one (20), resulting in an 18-fold improvement in potency against lck and a 50-fold increase in potency in a cellular assay.