(Z)-2-(4-Chlorophenyl)-3-(2-pyridyl)acrylonitrile

Base Information

• Chemical Name: (Z)-2-(4-Chlorophenyl)-3-(2-pyridyl)acrylonitrile
• CAS No.: 17999-67-6
• Molecular Formula: C14H9 Cl N2
• Molecular Weight: 240.692
• NSC Number: 111237
• Nikkaji Number: J800.474I
• Mol file: 17999-67-6.mol

Synonyms:17999-67-6;NSC111237;(Z)-2-(4-Chlorophenyl)-3-(2-pyridyl)acrylonitrile;NSC-111237

Chemical Property of (Z)-2-(4-Chlorophenyl)-3-(2-pyridyl)acrylonitrile

Chemical Property:

• Vapor Pressure: 4.81E-06mmHg at 25°C
• Boiling Point: 382.2°Cat760mmHg
• Flash Point: 184.9°C
• Density: 1.259g/cm³
• XLogP3: 3.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 240.0454260
• Heavy Atom Count: 17
• Complexity: 320

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=NC(=C1)C=C(C#N)C2=CC=C(C=C2)Cl
• Isomeric SMILES: C1=CC=NC(=C1)/C=C(\C#N)/C2=CC=C(C=C2)Cl

Technology Process of (Z)-2-(4-Chlorophenyl)-3-(2-pyridyl)acrylonitrile

There total 3 articles about (Z)-2-(4-Chlorophenyl)-3-(2-pyridyl)acrylonitrile 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: 73.0%

2-(4-chlorophenyl)indolizine (7496-73-3) → (Z)-2-(4-chlorophenyl)-3-(pyridin-2-yl)acrylonitrile (17999-67-6)

Guidance literature:

With tetra-(n-butyl)ammonium iodide; 1-azido-1λ³-benzo[d][1,2]iodaoxol-3(1H)-one; In dimethyl sulfoxide; at 20 ℃; for 5h; Schlenk technique;

DOI:10.1016/j.tet.2019.02.061

Reference yield:

pyridine-2-carbaldehyde (1121-60-4) + p-chlorobenzyl cyanide (140-53-4) → (Z)-2-(4-chlorophenyl)-3-(pyridin-2-yl)acrylonitrile (17999-67-6)

Guidance literature:

With methanol; sodium methylate;

DOI:10.1021/jo01365a004

Reference yield:

→ (Z)-2-(4-chlorophenyl)-3-(pyridin-2-yl)acrylonitrile (17999-67-6)

Guidance literature:

2-Formyl-pyridin, 4-Chlorphenylacetonitril;

DOI:10.1002/jps.2600561036

upstream raw materials:

pyridine-2-carbaldehyde

p-chlorobenzyl cyanide

2-(4-chlorophenyl)indolizine