2-methyl-N-(4-methylphenyl)benzamide

Base Information

• Chemical Name: 2-methyl-N-(4-methylphenyl)benzamide
• CAS No.: 58249-89-1
• Molecular Formula: C15H15 N O
• Molecular Weight: 225.29
• NSC Number: 27872
• DSSTox Substance ID: DTXSID60282744
• Wikidata: Q82017094
• ChEMBL ID: CHEMBL1214522
• Mol file: 58249-89-1.mol

Synonyms:2-methyl-N-(4-methylphenyl)benzamide;58249-89-1;2-Methyl-N-(p-tolyl)benzamide;NSC27872;p-[N-(p-tolyl)]toluamide;2-methyl-N-p-tolylbenzamide;SCHEMBL3684485;CHEMBL1214522;DTXSID60282744;HMS1589G04;NSC 27872;NSC-27872;STK058734;AKOS002960700;SR-01000252090;SR-01000252090-1

Chemical Property of 2-methyl-N-(4-methylphenyl)benzamide

Chemical Property:

• Vapor Pressure: 0.00166mmHg at 25°C
• Boiling Point: 294.1°Cat760mmHg
• Flash Point: 175.3°C
• Density: 1.121g/cm³
• XLogP3: 3.3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 225.115364102
• Heavy Atom Count: 17
• Complexity: 256

Purity/Quality:

85.0-99.8% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC=C(C=C1)NC(=O)C2=CC=CC=C2C

Technology Process of 2-methyl-N-(4-methylphenyl)benzamide

There total 19 articles about 2-methyl-N-(4-methylphenyl)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: 91.0%

p-toluidine (106-49-0,12221-03-3) + ortho-toluoyl chloride (933-88-0) → 2-methyl-N-(4-methylphenyl)-benzamide (58249-89-1)

Guidance literature:

With triethylamine; In dichloromethane; at 0 - 20 ℃;

DOI:10.1039/c4cc08717h

Reference yield: 87.0%

1-methyl-4-nitrobenzene (99-99-0) + 2-Methylphenylboronic acid (16419-60-6) + molybdenum hexacarbonyl (13939-06-5,199620-15-0) → 2-methyl-N-(4-methylphenyl)-benzamide (58249-89-1)

Guidance literature:

With 1,3-bis-(diphenylphosphino)propane; water; palladium(II) acetylacetonate; potassium carbonate; In acetonitrile; at 110 ℃; for 20h; Sealed tube; Inert atmosphere;

DOI:10.1021/acs.orglett.9b01772

Reference yield: 80.0%

N,2-dimethyl-N-phenylbenzamide (22978-37-6) + p-toluidine (106-49-0,12221-03-3) → 2-methyl-N-(4-methylphenyl)-benzamide (58249-89-1)

Guidance literature:

With lithium hexamethyldisilazane; In tetrahydrofuran; toluene; at 23 ℃; for 15h; chemoselective reaction; Inert atmosphere;

DOI:10.1021/jacs.9b04136

upstream raw materials:

2,4'-dimethyl-benzophenone oxime

ortho-methylbenzoic acid

p-toluidine

Benzoic acid 2-p-tolylcarbamoyl-benzyl ester

Downstream raw materials:

N-(4-methylphenyl)isoindolinone

3-(4-methoxyphenyl)-2-(p-tolyl)isoquinolin-1(2H)-one