Benzenamine, N-[1-(3-pyridinyl)ethylidene]-

Base Information

• Chemical Name: Benzenamine, N-[1-(3-pyridinyl)ethylidene]-
• CAS No.: 121133-22-0
• Molecular Formula: C13H12N2
• Molecular Weight: 196.252
• DSSTox Substance ID: DTXSID60445690
• Nikkaji Number: J1.117.065J
• Mol file: 121133-22-0.mol

Synonyms:Benzenamine, N-[1-(3-pyridinyl)ethylidene]-;121133-22-0;SCHEMBL7091419;DTXSID60445690;N-Phenyl-1-(3-pyridinyl)ethanimine

Chemical Property of Benzenamine, N-[1-(3-pyridinyl)ethylidene]-

Chemical Property:

• XLogP3: 2.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 196.100048391
• Heavy Atom Count: 15
• Complexity: 217

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(=NC1=CC=CC=C1)C2=CN=CC=C2

Technology Process of Benzenamine, N-[1-(3-pyridinyl)ethylidene]-

There total 3 articles about Benzenamine, N-[1-(3-pyridinyl)ethylidene]- 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: 88.0%

methyl-3-pyridylketone (350-03-8) + aniline (62-53-3) → N-[1-(pyridin-3-yl)ethylidene]aniline (121133-22-0)

Guidance literature:

With montmorillonite K-10 clay; In neat (no solvent); at 100 - 150 ℃; for 0.166667h; Microwave irradiation;

DOI:10.1002/jhet.1752

Reference yield: 42.0%

3-Ethynylpyridine (2510-23-8) + aniline (62-53-3) → 3-[(1-phenylimino)ethyl]pyridine (121133-22-0)

Guidance literature:

With [Au₂₅(SCH₂CH₂Ph)₁₈]⁰; In neat (no solvent); at 70 ℃; for 24h; Schlenk technique;

DOI:10.1055/s-0037-1610671

Reference yield:

methyl-3-pyridylketone (350-03-8) → 3-[(1-phenylimino)ethyl]pyridine (121133-22-0)

Guidance literature:

With aniline; In acetic acid; toluene;

upstream raw materials:

methyl-3-pyridylketone

aniline

3-Ethynylpyridine

Downstream raw materials:

(N-phenyl)-1-(pyridin-3-yl)ethanamine