4-methoxy-N-(3-methylphenyl)-N-[(2-oxo-1,2-dihydroquinolin-3-yl)methyl]benzamide

Base Information

• Chemical Name: 4-methoxy-N-(3-methylphenyl)-N-[(2-oxo-1,2-dihydroquinolin-3-yl)methyl]benzamide
• CAS No.: 5682-73-5
• Molecular Formula: C25H22N2O3
• Molecular Weight: 154.209
• DSSTox Substance ID: DTXSID10397099
• Mol file: 5682-73-5.mol

Synonyms:5682-73-5;AC1MYQDL;DTXSID10397099;STL038080;AKOS003657581;AKOS005691906;N-((2-hydroxyquinolin-3-yl)methyl)-4-methoxy-N-(m-tolyl)benzamide;4-methoxy-N-(3-methylphenyl)-N-[(2-oxo-1,2-dihydroquinolin-3-yl)methyl]benzamide

Chemical Property of 4-methoxy-N-(3-methylphenyl)-N-[(2-oxo-1,2-dihydroquinolin-3-yl)methyl]benzamide

Chemical Property:

• Vapor Pressure: 5.98E-17mmHg at 25°C
• Boiling Point: 653.3°C at 760 mmHg
• Flash Point: 348.9°C
• Density: 1.232g/cm³
• XLogP3: 4.2
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 5
• Exact Mass: 398.16304257
• Heavy Atom Count: 30
• Complexity: 653

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC(=CC=C1)N(CC2=CC3=CC=CC=C3NC2=O)C(=O)C4=CC=C(C=C4)OC

Technology Process of 4-methoxy-N-(3-methylphenyl)-N-[(2-oxo-1,2-dihydroquinolin-3-yl)methyl]benzamide

There total 3 articles about 4-methoxy-N-(3-methylphenyl)-N-[(2-oxo-1,2-dihydroquinolin-3-yl)methyl]benzamide 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: 44.0%

2-methyl-propan-1-ol (78-83-1) + cyclopentanone (120-92-3) → 2-isobutoxycyclopent-2-enone (5682-73-5)

Guidance literature:

With iodine; copper(II) oxide; at 100 ℃; for 12h;

DOI:10.1002/ejoc.202001140

Reference yield:

(+/-)-2-isobutoxycyclopent-2-enol (1207204-57-6) → (S)-2-isobutoxycyclopent-2-enol (1207204-74-7) + 2-isobutoxycyclopent-2-enone (5682-73-5)

Guidance literature:

With oxygen; caesium carbonate; (-)-sparteine; In chloroform; at 23 ℃; for 45h; under 760.051 Torr; optical yield given as %ee; Molecular sieve;

DOI:10.1002/chem.200902172

Reference yield:

cyclopentane-1,2-dione (3008-40-0) + 2-methyl-propan-1-ol (78-83-1) → 2-isobutoxycyclopent-2-enone (5682-73-5)

Guidance literature:

With toluene-4-sulfonic acid; benzene; unter Entfernen des entstehendes H₂O;

DOI:10.1039/jr9590000329

upstream raw materials:

cyclopentane-1,2-dione

2-methyl-propan-1-ol

(+/-)-2-isobutoxycyclopent-2-enol

cyclopentanone

Downstream raw materials:

2-phenethylcyclopent-2-en-1-one

2-phenylcyclopent-2-enone

2-pentyl-2-cyclopenten-1-one

2-ethylcyclopent-2-en-1-one