N-(4-chlorophenyl)-3-methylbenzamide

Base Information

• Chemical Name: N-(4-chlorophenyl)-3-methylbenzamide
• CAS No.: 81636-14-8
• Molecular Formula: C14H12ClNO
• Molecular Weight: 245.708
• European Community (EC) Number: 666-936-2
• Nikkaji Number: J3.170.818D
• Mol file: 81636-14-8.mol

Synonyms:N-(4-chlorophenyl)-3-methylbenzamide;81636-14-8;Cambridge id 5261592;CBDivE_014249;SCHEMBL4248711;DDOSHRIGQWXMMY-UHFFFAOYSA-N;MFCD00088528;STK414179;AKOS002960126;11F-368S;Benzamide, 3-methyl-N-(4-chlorophenyl)-;CS-0326354;AG-205/03623021

Chemical Property of N-(4-chlorophenyl)-3-methylbenzamide

Chemical Property:

• XLogP3: 3.7
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 245.0607417
• Heavy Atom Count: 17
• Complexity: 261

Purity/Quality:

99% ^*data from raw suppliers

N-(4-CHLOROPHENYL)-3-METHYLBENZENECARBOXAMIDE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC(=CC=C1)C(=O)NC2=CC=C(C=C2)Cl

Technology Process of N-(4-chlorophenyl)-3-methylbenzamide

There total 7 articles about N-(4-chlorophenyl)-3-methylbenzamide 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: 92.0%

1-Chloro-4-iodobenzene (637-87-6) + para-methylbenzamide (619-55-6) → N-(4-chlorophenyl)-3-methylbenzamide (81636-14-8)

Guidance literature:

With copper(l) iodide; manganese(II) fluoride; (±)-trans-1,2-diaminocyclohexane; potassium hydroxide; In water; at 60 ℃; for 24h;

DOI:10.1002/ejoc.201201218

Reference yield: 72.0%

1-Chloro-4-iodobenzene (637-87-6) + m-toluamide (618-47-3) → N-(4-chlorophenyl)-3-methylbenzamide (81636-14-8)

Guidance literature:

With copper(l) iodide; manganese(II) fluoride; (±)-trans-1,2-diaminocyclohexane; potassium hydroxide; In water; at 60 ℃; for 24h;

DOI:10.1002/ejoc.201201218

Reference yield: 55.0%

carbon monoxide (201230-82-2) + m-tolylboronic acid (17933-03-8) + N-4-chlorophenylhydrazine (1073-69-4) → N-(4-chlorophenyl)-3-methylbenzamide (81636-14-8)

Guidance literature:

With bis-triphenylphosphine-palladium(II) chloride; iron(II) chloride; In cyclohexane; at 80 ℃; for 24h; under 37503.8 Torr;

upstream raw materials:

4-chloro-aniline

3-Methylbenzoyl chloride

1-Chloro-4-iodobenzene

m-toluamide

Downstream raw materials:

N-(4-chlorophenyl)-3-methylbenzimidoyl chloride

4-(4-chlorophenyl)-3-(4-nitrophenyl)-5-m-tolyl-4H-[1,2,4]triazole

C₁₄H₁₂ClNS

6-chloro-2-(m-tolyl)benzo[d]thiazole