n-(4-Hydroxyphenyl)benzenesulfonamide

Base Information

• Chemical Name: n-(4-Hydroxyphenyl)benzenesulfonamide
• CAS No.: 5471-90-9
• Deprecated CAS: 1331285-21-2
• Molecular Formula: C12H11NO3S
• Molecular Weight: 249.29
• Hs Code.: 2935009090
• European Community (EC) Number: 654-333-7
• NSC Number: 28472
• DSSTox Substance ID: DTXSID1063934
• Nikkaji Number: J1.586.948H
• Wikidata: Q81991111
• Mol file: 5471-90-9.mol

Synonyms:n-(4-hydroxyphenyl)benzenesulfonamide;5471-90-9;Benzenesulfonamide, N-(4-hydroxyphenyl)-;EC 654-333-7;NSC28472;p-benzenesulfonamidophenol;Oprea1_750995;Oprea1_774277;4'-Hydroxybenzenesulfonanilide;SCHEMBL523563;DTXSID1063934;N-4-hydroxyphenyl-benzenesulphonamide;NSC 28472;NSC-28472;AKOS002305765;n-(4-hydroxyphenyl)benzenesulphonamide;CS-0356404;FT-0762065;EN300-56924;A913816;AG-668/02826022;Z45652933

Chemical Property of n-(4-Hydroxyphenyl)benzenesulfonamide

Chemical Property:

• Vapor Pressure: 1.82E-08mmHg at 25°C
• Melting Point: 156 °C(Solv: ethyl acetate (141-78-6))
• Boiling Point: 443.2°Cat760mmHg
• PKA: 9.65±0.10(Predicted)
• Flash Point: 221.8°C
• PSA: 74.78000
• Density: 1.408g/cm³
• LogP: 3.34680
• XLogP3: 1.9
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 3
• Exact Mass: 249.04596439
• Heavy Atom Count: 17
• Complexity: 322

Purity/Quality:

99.9% ^*data from raw suppliers

N-(4-Hydroxyphenyl)benzenesulfonamide 99% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

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

Technology Process of n-(4-Hydroxyphenyl)benzenesulfonamide

There total 9 articles about n-(4-Hydroxyphenyl)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: 77.0%

4-amino-phenol (123-30-8) + benzenesulfonyl chloride (98-09-9) → N-(4-hydroxyphenyl)benzenesulfonamide (5471-90-9)

Guidance literature:

With pyridine; In N,N-dimethyl-formamide; at 0 - 20 ℃; Inert atmosphere;

DOI:10.1016/j.tet.2011.09.020

Reference yield: 68.0%

phenylsulfonyl fluoride (368-43-4) + 4-amino-phenol (123-30-8) → N-(4-hydroxyphenyl)benzenesulfonamide (5471-90-9)

Guidance literature:

With calcium(II) bis(trifluoromethanesulfonyl)imide; In tert-Amyl alcohol; at 60 ℃; for 24h;

DOI:10.1021/acs.orglett.8b01520

Reference yield: 25.0%

N-(phenylsulfonyl)-1,4-benzoquinone monoimine (4056-56-8) + Dimethyl phosphite (868-85-9) → N-(4-hydroxyphenyl)benzenesulfonamide (5471-90-9) + dimethyl <2-hydroxy-5-((phenylsulfonyl)amino)phenyl>phosphonate

Guidance literature:

In benzene; for 16h; Heating;

DOI:10.1016/S0040-4020(01)81299-0

upstream raw materials:

4-amino-phenol

benzenesulfonyl chloride

diisopropyl hydrogenphosphonate

N-(phenylsulfonyl)-1,4-benzoquinone monoimine

Downstream raw materials:

N-(phenylsulfonyl)-1,4-benzoquinone monoimine

2,6-bis(1-pyrrolidinylmethyl)-4-benzenesulfonamidophenol

tetrabromobenzoquinone

N-benzenesulfonyl-2,6-dibromo-1,4-benzoquinone imine