n-(3,4-Dichlorophenyl)-4-methylbenzenesulfonamide

Base Information

• Chemical Name: n-(3,4-Dichlorophenyl)-4-methylbenzenesulfonamide
• CAS No.: 16964-21-9
• Molecular Formula: C13H11 Cl2 N O2 S
• Molecular Weight: 316.2029
• NSC Number: 35193
• ChEMBL ID: CHEMBL299775
• Mol file: 16964-21-9.mol

Synonyms:n-(3,4-dichlorophenyl)-4-methylbenzenesulfonamide;NSC35193;Cambridge id 5145066;CHEMBL299775;SCHEMBL7571133;NSC-35193;AKOS003980193

Chemical Property of n-(3,4-Dichlorophenyl)-4-methylbenzenesulfonamide

Chemical Property:

• Vapor Pressure: 5.88E-08mmHg at 25°C
• Boiling Point: 440.5°C at 760 mmHg
• Flash Point: 220.2°C
• Density: 1.445g/cm³
• XLogP3: 4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 314.9887552
• Heavy Atom Count: 19
• Complexity: 388

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

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

Technology Process of n-(3,4-Dichlorophenyl)-4-methylbenzenesulfonamide

There total 2 articles about n-(3,4-Dichlorophenyl)-4-methylbenzenesulfonamide 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:

p-toluenesulfonyl chloride (98-59-9) + m,p-dichloroaniline (95-76-1) → 3,4-dichloro-N-tosylaniline (16964-21-9)

Guidance literature:

With pyridine; In N,N-dimethyl-formamide; benzene; for 24h; Ambient temperature;

Reference yield:

→ 3,4-dichloro-N-tosylaniline (16964-21-9)

Guidance literature:

p-Toluolsulfochlorid, 3,4-Dichlor-anilin;

Reference yield: 86.0%

3,4-dichloro-N-tosylaniline (16964-21-9) + 2-bromo-3-(bromomethyl)-1-(2-mesitylenesulfonyl)-1H-indole → N-((2-bromo-1-(2-mesitylenesulfonyl)-1H-indol-3-yl)methyl)-N-(3,4-dichlorophenyl)-4-methylbenzenesulfonamide

Guidance literature:

With potassium carbonate; In N,N-dimethyl-formamide; at 20 ℃; for 12h; Inert atmosphere;

DOI:10.1021/acs.joc.0c02152

upstream raw materials:

p-toluenesulfonyl chloride

m,p-dichloroaniline

Downstream raw materials:

3,4-dichloro-N-(α-methoxyphenacyl)-N-tosylaniline

3,4-dichloro-N-phenacyl-N-tosylaniline

N-(3,4-Dichloro-phenyl)-4-methyl-N-oxiranylmethyl-benzenesulfonamide

N-(3,4-Dichloro-phenyl)-N-[2-hydroxy-3-(4-phenyl-piperazin-1-yl)-propyl]-4-methyl-benzenesulfonamide