N-(3,5-Dichloro-4-hydroxy-phenyl)-4-methyl-benzenesulfonamide

Base Information

• Chemical Name: N-(3,5-Dichloro-4-hydroxy-phenyl)-4-methyl-benzenesulfonamide
• CAS No.: 59876-72-1
• Molecular Formula: C13H11Cl2NO3S
• Molecular Weight: 332.207
• Hs Code.: 2935009090
• European Community (EC) Number: 654-103-6
• DSSTox Substance ID: DTXSID20356839
• Wikidata: Q82136440

Synonyms:59876-72-1;Benzenesulfonamide, N-(3,5-dichloro-4-hydroxyphenyl)-4-methyl-;N-(3,5-Dichloro-4-hydroxy-phenyl)-4-methyl-benzenesulfonamide;N-(3,5-dichloro-4-hydroxyphenyl)-4-methylbenzenesulfonamide;ST50546705;CBMicro_012435;Oprea1_322069;Oprea1_451201;DTXSID20356839;SMSF0003983;AKOS002306726;CB15636;BIM-0012327.P001;N-(p-tolylsulfonyl)-2,6-dichloro-4-aminophenol

Chemical Property of N-(3,5-Dichloro-4-hydroxy-phenyl)-4-methyl-benzenesulfonamide

Chemical Property:

• PSA: 74.78000
• LogP: 4.96200
• XLogP3: 3.7
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 3
• Exact Mass: 330.9836698
• Heavy Atom Count: 20
• Complexity: 406

Purity/Quality:

N-(3,5-DICHLORO-4-HYDROXY-PHENYL)-4-METHYL-BENZENESULFONAMIDE 95.00% ^*data from reagent 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)O)Cl

Technology Process of N-(3,5-Dichloro-4-hydroxy-phenyl)-4-methyl-benzenesulfonamide

There total 1 articles about N-(3,5-Dichloro-4-hydroxy-phenyl)-4-methyl-benzenesulfonamide 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:

N-p-methylbenzenesulfonyl-2,6-dichloro-1,4-benzoquinone imine (59876-73-2) → N-(3,5-dichloro-4-hydroxyphenyl)-p-toluenesulfonamide (59876-72-1)

Guidance literature:

With diethyl 2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate; In chloroform; at 25 ℃; Rate constant; Mechanism;

Reference yield: 66.0%

N-(3,5-dichloro-4-hydroxyphenyl)-p-toluenesulfonamide (59876-72-1) → 2,3,5,5,6,6-hexachloro-4-<(p-tolylsulfonyl)imino>-2-cyclohexen-1-one (141481-37-0)

Guidance literature:

With chlorine; In N,N-dimethyl-formamide; at 36 ℃;

Reference yield: 56.0%

N-(3,5-dichloro-4-hydroxyphenyl)-p-toluenesulfonamide (59876-72-1) → N-p-methylbenzenesulfonyl-2,3,6-trichloro-1,4-benzoquinone imine (68374-97-0)

Guidance literature:

With chlorine; In N,N-dimethyl-formamide; at 32 ℃;

upstream raw materials:

N-p-methylbenzenesulfonyl-2,6-dichloro-1,4-benzoquinone imine

Downstream raw materials:

2,3,5,5,6,6-hexachloro-2-cyclohexene-1,4-dione

chloranil

N-p-methylbenzenesulfonyl-2,3,6-trichloro-1,4-benzoquinone imine

2,3,5,5,6,6-hexachloro-4-<(p-tolylsulfonyl)imino>-2-cyclohexen-1-one

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