(2z)-(4-Chlorophenyl){[4-(dimethylamino)phenyl]imino}ethanenitrile

Base Information

• Chemical Name: (2z)-(4-Chlorophenyl){[4-(dimethylamino)phenyl]imino}ethanenitrile
• CAS No.: 21994-57-0
• Molecular Formula: C₁₆H₁₄ClN₃
• Molecular Weight: 283.76
• NSC Number: 126365
• DSSTox Substance ID: DTXSID40298823
• Mol file: 21994-57-0.mol

Synonyms:21994-57-0;(2z)-(4-chlorophenyl){[4-(dimethylamino)phenyl]imino}ethanenitrile;NSC126365;DTXSID40298823;(2Z)-(4-chlorophenyl){[4-(dimethylamino)phenyl]imino}acetonitrile;NSC-126365

Chemical Property of (2z)-(4-Chlorophenyl){[4-(dimethylamino)phenyl]imino}ethanenitrile

Chemical Property:

• Vapor Pressure: 1.22E-07mmHg at 25°C
• Boiling Point: 431.2°C at 760 mmHg
• Flash Point: 214.6°C
• Density: 1.12g/cm³
• XLogP3: 4.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 283.0876252
• Heavy Atom Count: 20
• Complexity: 380

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CN(C)C1=CC=C(C=C1)N=C(C#N)C2=CC=C(C=C2)Cl

Technology Process of (2z)-(4-Chlorophenyl){[4-(dimethylamino)phenyl]imino}ethanenitrile

There total 5 articles about (2z)-(4-Chlorophenyl){[4-(dimethylamino)phenyl]imino}ethanenitrile 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:

4-chloro-benzaldehyde-[N-(4-dimethylamino-phenyl)-oxime ] (42197-34-2) + sodium cyanide (143-33-9,25596-52-5) → (4-chloro-phenyl)-(4-dimethylamino-phenylimino)-acetonitrile (21994-57-0)

Guidance literature:

With ethanol;

Reference yield:

N-(4-chlorobenzyl)-pyridinium bromide (139326-89-9) + p-dimethylaminonitrosobenzene (138-89-6) → (4-chloro-phenyl)-(4-dimethylamino-phenylimino)-acetonitrile (21994-57-0)

Guidance literature:

With ethanol; acetone; anschliessendes Behandeln mit wss.KCN;

Reference yield:

2,3-dimethyl-4-nitroso-aniline (871876-73-2) + p-chlorobenzyl cyanide (140-53-4) → (4-chloro-phenyl)-(4-dimethylamino-phenylimino)-acetonitrile (21994-57-0)

Guidance literature:

With methanol; sodium hydroxide;

upstream raw materials:

4-chloro-benzaldehyde-[N-(4-dimethylamino-phenyl)-oxime ]

sodium cyanide

N-(4-chlorobenzyl)-pyridinium bromide

p-dimethylaminonitrosobenzene

Downstream raw materials:

4-chlorobenzoyl cyanide