2-(2-Chlorophenyl)-3-(4-(dimethylamino)phenyl)acrylonitrile

Base Information

• Chemical Name: 2-(2-Chlorophenyl)-3-(4-(dimethylamino)phenyl)acrylonitrile
• CAS No.: 7496-17-5
• Molecular Formula: C₁₇H₁₅ClN₂
• Molecular Weight: 282.772
• NSC Number: 405101
• ChEMBL ID: CHEMBL2030543
• Mol file: 7496-17-5.mol

Synonyms:NSC405101;NSC 405101;7496-17-5;CHEMBL2030543;2-(2-Chlorophenyl)-3-(4-(dimethylamino)phenyl)acrylonitrile;SCHEMBL14964848;(Z)-2-(2-chlorophenyl)-3-(4-dimethylaminophenyl)prop-2-enenitrile;BDBM50383370;NSC-405101

Chemical Property of 2-(2-Chlorophenyl)-3-(4-(dimethylamino)phenyl)acrylonitrile

Chemical Property:

• Vapor Pressure: 1.08E-07mmHg at 25°C
• Boiling Point: 432.8°C at 760 mmHg
• Flash Point: 215.5°C
• Density: 1.199g/cm³
• XLogP3: 4.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 282.0923762
• Heavy Atom Count: 20
• Complexity: 385

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CN(C)C1=CC=C(C=C1)C=C(C#N)C2=CC=CC=C2Cl
• Isomeric SMILES: CN(C)C1=CC=C(C=C1)/C=C(\C#N)/C2=CC=CC=C2Cl

Technology Process of 2-(2-Chlorophenyl)-3-(4-(dimethylamino)phenyl)acrylonitrile

There total 2 articles about 2-(2-Chlorophenyl)-3-(4-(dimethylamino)phenyl)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: 49.0%

2-Chlorophenylacetonitrile (2856-63-5) + 4-dimethylamino-benzaldehyde (100-10-7) → DG138 (7496-17-5)

Guidance literature:

With pyrrolidine; In methanol; for 60h;

DOI:10.1021/jm2017122

Reference yield:

→ DG138 (7496-17-5)

Guidance literature:

/BRN= 3142432/;

DOI:10.1021/jo01353a028

upstream raw materials:

2-Chlorophenylacetonitrile

4-dimethylamino-benzaldehyde