N-(2-hydroxyphenyl)-4-methylbenzenesulfonamide

Base Information

• Chemical Name: N-(2-hydroxyphenyl)-4-methylbenzenesulfonamide
• CAS No.: 3897-39-0
• Molecular Formula: C13H13 N O3 S
• Molecular Weight: 263.317
• Hs Code.: 2935009090
• NSC Number: 140147
• DSSTox Substance ID: DTXSID40959821
• Nikkaji Number: J953.262E
• Wikidata: Q82940730
• ChEMBL ID: CHEMBL2354867
• Mol file: 3897-39-0.mol

Synonyms:N-(2-hydroxyphenyl)-4-methylbenzenesulfonamide;3897-39-0;N-(2-Hydroxy-phenyl)-4-methyl-benzenesulfonamide;N-(2-hydroxyphenyl)-4-methylbenzene-1-sulfonamide;NSC140147;Oprea1_201834;MLS003675155;SCHEMBL1348234;CHEMBL2354867;DTXSID40959821;JDCWGLBOQFHJQM-UHFFFAOYSA-N;MFCD00697555;AKOS003323400;NSC-140147;SB81741;N-(2-hydroxyphenyl)-p-toluenesulfonamide;SMR002355603;N-(2-hydroxyphenyl)-4-methyl-benzenesulfonamide;A824517

Chemical Property of N-(2-hydroxyphenyl)-4-methylbenzenesulfonamide

Chemical Property:

• Vapor Pressure: 1.02E-07mmHg at 25°C
• Boiling Point: 422°Cat760mmHg
• Flash Point: 209°C
• PSA: 74.78000
• Density: 1.362g/cm³
• LogP: 3.65520
• XLogP3: 2.1
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 3
• Exact Mass: 263.06161445
• Heavy Atom Count: 18
• Complexity: 355

Purity/Quality:

99% ^*data from raw suppliers

N-(2-Hydroxyphenyl)-4-methylbenzenesulfonamide 95+% ^*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=CC=C2O

Technology Process of N-(2-hydroxyphenyl)-4-methylbenzenesulfonamide

There total 25 articles about N-(2-hydroxyphenyl)-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: 95.0%

2-amino-phenol (95-55-6) + p-toluenesulfonyl chloride (98-59-9) → N-(2-hydroxy-phenyl)-toluene-4-sulfonamide (3897-39-0)

Guidance literature:

With pyridine; In dichloromethane; for 1h; Ambient temperature;

DOI:10.1021/jo00349a013

Reference yield: 94.0%

2-{[(4-methylphenyl)sulfonyl]amino}phenyl 4-meythylbenzenesulfonate (81256-20-4) → N-(2-hydroxy-phenyl)-toluene-4-sulfonamide (3897-39-0)

Guidance literature:

2-{[(4-methylphenyl)sulfonyl]amino}phenyl 4-meythylbenzenesulfonate; With magnesium; In methanol; at 20 ℃; for 8h;

With hydrogenchloride; In water;

DOI:10.1016/j.tet.2009.10.061

Reference yield: 87.0%

C20H19NO5S2 → N-(2-hydroxy-phenyl)-toluene-4-sulfonamide (3897-39-0)

Guidance literature:

With magnesium; In methanol; at 40 ℃; for 12h;

DOI:10.1021/acs.orglett.8b00352

upstream raw materials:

1-methyl-4-nitrosobenzene

2-amino-phenol

p-toluenesulfonyl chloride

2-aminophenyl p-toluenesulfonate

Downstream raw materials:

N-Tosylbenzophenoxazine-6,11-dione

toluene-4-sulfonic acid-(2-hydroxy-3,5-dinitro-anilide)

2-{[(4-methylphenyl)sulfonyl]amino}phenyl 4-meythylbenzenesulfonate

3-(p-tolylsulfonyl)-1,2,3-benzoxathiazole 2-oxide

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