1190129-80-6

Basic information

• Product Name: 2-[Methyl(3-nitrophenyl)aMino]- acetonitrile
• Synonyms: 2-[Methyl(3-nitrophenyl)aMino]- acetonitrile
• CAS NO: 1190129-80-6
• Molecular Formula: C₉H₉N₃O₂
• Molecular Weight: 191.18666
• Mol File: 1190129-80-6.mol

Chemical Properties

• Melting Point: 99.3-99.5℃ (ethyl ether pentane )
• Boiling Point: 360.4±22.0 °C(Predicted)
• Appearance: Colorless to slightly yellow thick liquid
• Density: 1.281±0.06 g/cm3(Predicted)
• PKA: -0.81±0.50(Predicted)
• CAS DataBase Reference: 2-[Methyl(3-nitrophenyl)aMino]- acetonitrile(CAS DataBase Reference)
• NIST Chemistry Reference: 2-[Methyl(3-nitrophenyl)aMino]- acetonitrile(1190129-80-6)
• EPA Substance Registry System: 2-[Methyl(3-nitrophenyl)aMino]- acetonitrile(1190129-80-6)

Safety Data

• Hazardous Substances Data: 1190129-80-6(Hazardous Substances Data)

Usage

Uses

Used in Organic Synthesis:
2-[Methyl(3-nitrophenyl)aMino]acetonitrile is utilized as a key intermediate in organic synthesis for the preparation of a variety of chemical compounds. Its unique structure allows for versatile reactions, making it a valuable component in the synthesis of pharmaceuticals, agrochemicals, and other specialty chemicals.
Used in Medicinal Chemistry:
In the field of medicinal chemistry, 2-[Methyl(3-nitrophenyl)aMino]acetonitrile is employed as a building block for the development of new pharmaceutical agents. Its structural features can be modified to create novel molecules with potential therapeutic properties, contributing to the discovery of new drugs for various diseases and medical conditions.
Used in Chemical Research:
2-[Methyl(3-nitrophenyl)aMino]acetonitrile also serves as a subject of interest in chemical research, where it is studied for its reactivity, stability, and potential applications in the synthesis of new materials and compounds. Researchers explore its properties to gain insights into the broader scope of chemical reactions and mechanisms involving aminonitrile derivatives.
Used in Specialty Chemicals Production:
2-[Methyl(3-nitrophenyl)aMino]acetonitrile finds application in the production of specialty chemicals, where its unique structural elements are leveraged to create high-value products for specific industries. The versatility of 2-[Methyl(3-nitrophenyl)aMino]acetonitrile makes it suitable for use in the development of advanced materials, dyes, and other specialty chemicals that require precise molecular structures.

Upstream product

• 773837-37-9 sodium cyanide 
• 619-31-8 N,N-dimethyl-3-nitroaniline 
• 7677-24-9 trimethylsilyl cyanide 

Relevant articles and documents

Highly efficient and recyclable magnetic nanoparticles-supported gold(III)-bipy catalyst for oxidative α-cyanation of tertiary amines

Oxidative α-cyanation of tertiary amines with trimethylsilyl cyanide was achieved by using a magnetic nanoparticles-supported gold(III)-bipy complex as catalyst to afford the corresponding α-aminonitriles in good to excellent yields in the presence of ter

Direct oxidative cyanation of tertiary amines promoted by in situ generated hypervalent iodine(III)-CN intermediate

An environmentally benign and metal-free cyanation method of tertiary amines oxidated by hypervalent iodine(III) intermediate generated in situ from PIFA (or DIB) and TMSCN has been developed. A variety of substituent groups on amines are tolerated to the oxidation of α-C-H bond to form C-C bond in the absence of metal catalysts with yields of up to 74%.

Heterogeneously catalyzed oxidative cyanation of tertiary amines with sodium cyanide/hydrogen peroxide using polymer-supported iron(II) phthalocyanines as catalyst

The first report on heterogeneously catalyzed oxidative cyanation of various tertiary amines to the corresponding a-amino nitriles with high yields and selectivity by using hydrogen peroxide oxidant in presence of sodium cyanide and Fe(II) phthalocyanine supported on a polymer as catalyst is described. The present method has the added benefits of facile recovery of the catalyst from the reaction mixture and its subsequent use without further activation. Consistent catalytic activity with no metal leaching was observed during this course.

Iron catalyzed oxidative cyanation of tertiary amines

Iron(ii) and iron(iii) salts catalyze the oxidative α-cyanation of tertiary amines by trimethylsilyl cyanide in the presence of tert-butylhydroperoxide under acid-free conditions at room temperature.