Acetonitrile, [methyl(3-methylphenyl)amino]- (9CI)

Base Information

• Chemical Name: Acetonitrile, [methyl(3-methylphenyl)amino]- (9CI)
• CAS No.: 635683-12-4
• Molecular Formula: C₁₀H₁₂N₂
• Molecular Weight: 160.219
• Hs Code.: 2926909090
• Mol file: 635683-12-4.mol

Synonyms:[Methyl(3-methylphenyl)amino]acetonitrile;2-(N,3-Dimethylanilino)acetonitrile;Acetonitrile, 2-[methyl(3-methylphenyl)amino]-;N-Methyl-N-(cyanoethyl)-m-toluidine;

Chemical Property of Acetonitrile, [methyl(3-methylphenyl)amino]- (9CI)

Chemical Property:

• Boiling Point: 291.791 °C at 760 mmHg
• PKA: 1.81±0.50(Predicted)
• Flash Point: 124.119 °C
• PSA: 27.03000
• Density: 1.043 g/cm³
• LogP: 1.95478

Purity/Quality:

98%Min ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

Technology Process of Acetonitrile, [methyl(3-methylphenyl)amino]- (9CI)

There total 16 articles about Acetonitrile, [methyl(3-methylphenyl)amino]- (9CI) which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 98.0%

N,N-dimethyl-m-toluidine (121-72-2) + trimethylsilyl cyanide (7677-24-9) → N-methyl-N-(3-methylphenyl)aminoacetonitrile (635683-12-4)

Guidance literature:

With tert.-butylhydroperoxide; [(bpy)AuCl₂]Cl; In methanol; decane; at 20 ℃; for 5h; regioselective reaction;

DOI:10.1039/c0cc03844j

Reference yield: 97.0%

sodium cyanide (773837-37-9) + N,N-dimethyl-m-toluidine (121-72-2) → N-methyl-N-(3-methylphenyl)aminoacetonitrile (635683-12-4)

Guidance literature:

With dihydrogen peroxide; acetic acid; In water; at 20 ℃; for 0.416667h;

DOI:10.1039/c5cc05895c

Reference yield: 86.0%

N,N-dimethyl-m-toluidine (121-72-2) → N-methyl-N-(3-methylphenyl)aminoacetonitrile (635683-12-4)

Guidance literature:

With rhodium(III) chloride hydrate; dihydrogen peroxide; In water; at 50 ℃; for 4h;

DOI:10.1016/j.tetlet.2015.05.033

upstream raw materials:

N,N-dimethyl-m-toluidine

iodoacetonitrile

sodium cyanide

sodium cyanide