2-{[(4-chlorophenyl)methyl]amino}acetonitrile

Base Information

• Chemical Name: 2-{[(4-chlorophenyl)methyl]amino}acetonitrile
• CAS No.: 63086-19-1
• Molecular Formula: C9H9ClN2
• Molecular Weight: 180.63400
• Mol file: 63086-19-1.mol

Synonyms:N-(4-chloro-benzyl)-glycine nitrile;N-(4-Chlor-benzyl)-glycin-nitril;(4-Chloro-benzylamino)-acetonitrile;(4-chlorobenzylamino)acetonitrile;

Chemical Property of 2-{[(4-chlorophenyl)methyl]amino}acetonitrile

Chemical Property:

• PSA: 35.82000
• LogP: 2.34408

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

Technology Process of 2-{[(4-chlorophenyl)methyl]amino}acetonitrile

There total 3 articles about 2-{[(4-chlorophenyl)methyl]amino}acetonitrile 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: 84.0%

4-chlorobenzylamine (104-86-9) + cyanomethyl bromide (590-17-0) → 2-[(4-chlorobenzyl)amino]acetonitrile (63086-19-1)

Guidance literature:

4-chlorobenzylamine; With caesium carbonate; In N,N-dimethyl-formamide; at 25 ℃; for 0.5h;

cyanomethyl bromide; In N,N-dimethyl-formamide; at 25 ℃; for 24h; chemoselective reaction; Microwave irradiation;

DOI:10.1002/ejoc.201600549

Reference yield:

formaldehyd (50-00-0,30525-89-4,61233-19-0) + potassium cyanide (151-50-8) + 4-chlorobenzylamine (104-86-9) → 2-[(4-chlorobenzyl)amino]acetonitrile (63086-19-1)

Guidance literature:

With water;

DOI:10.1021/ja01604a066

Reference yield:

→ 2-[(4-chlorobenzyl)amino]acetonitrile (63086-19-1)

Guidance literature:

upstream raw materials:

formaldehyd

potassium cyanide

4-chlorobenzylamine

cyanomethyl bromide

Downstream raw materials:

1-(2-benzo[b]thiophen-3-yl-acetyl)-2-methylazetidine-2-carboxylic acid (4-chlorobenzyl)cyanomethylamide

N-(4-chloro-benzyl)-glycine amide; hydrochloride