1-Methyl-4-(4-nitrobenzylidene)-1,4-dihydropyridine

Base Information

• Chemical Name: 1-Methyl-4-(4-nitrobenzylidene)-1,4-dihydropyridine
• CAS No.: 2590-87-6
• Molecular Formula: C₁₃H₁₂N₂O₂
• Molecular Weight: 228.25
• European Community (EC) Number: 666-788-9
• Nikkaji Number: J699.274I
• Mol file: 2590-87-6.mol

Synonyms:1-Methyl-4-(4-nitrobenzylidene)-1,4-dihydropyridine;SCHEMBL17737254;AKOS024323921

Chemical Property of 1-Methyl-4-(4-nitrobenzylidene)-1,4-dihydropyridine

Chemical Property:

• XLogP3: 2.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 228.089877630
• Heavy Atom Count: 17
• Complexity: 355

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CN1C=CC(=CC2=CC=C(C=C2)[N+](=O)[O-])C=C1

Technology Process of 1-Methyl-4-(4-nitrobenzylidene)-1,4-dihydropyridine

There total 3 articles about 1-Methyl-4-(4-nitrobenzylidene)-1,4-dihydropyridine 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-Nitrobenzylpyridin (1083-48-3) + methyl iodide (74-88-4) → 1-methyl-4-(4-nitro-benzylidene)-1,4-dihydro-pyridine (2590-87-6)

Guidance literature:

With triethylamine; 1.) 70 deg C, 1 h; 2.) acetone;

Reference yield:

→ 1-methyl-4-(4-nitro-benzylidene)-1,4-dihydro-pyridine (2590-87-6)

Guidance literature:

Aus N-Methyl-4-<4-nitro-benzyl>-1,4-pyridinium-perchlorat u. wss. KOH;

Reference yield:

methyl-NBP iodide (58100-27-9) → 1-methyl-4-(4-nitro-benzylidene)-1,4-dihydro-pyridine (2590-87-6)

Guidance literature:

upstream raw materials:

4-Nitrobenzylpyridin

methyl iodide

methyl-NBP iodide