4-{[(4-Chlorophenyl)sulfonyl]amino}benzoic acid

Base Information

Chemical Name:4-{[(4-Chlorophenyl)sulfonyl]amino}benzoic acid
CAS No.:63421-70-5
Molecular Formula:C13H10ClNO4S
Molecular Weight:311.746
Hs Code.:
DSSTox Substance ID:DTXSID80965289
ChEMBL ID:CHEMBL491747
Mol file:63421-70-5.mol

Synonyms:4-{[(4-chlorophenyl)sulfonyl]amino}benzoic acid;4-[(4-chlorophenyl)sulfonylamino]benzoic acid;63421-70-5;Benzoic acid, 4-[[(4-chlorophenyl)sulfonyl]amino]-;BRN 2390388;MLS000060881;CHEMBL491747;SCHEMBL9285136;DTXSID80965289;HMS2399L23;STK698522;AKOS000727950;UPCMLD0ENAT5417426:001;LS-36628;SMR000069109;4-(4-Chlorophenylsulfonamido)benzoic Acid;4-(4-chloro-benzenesulphonylamino)-benzoic acid;AG-690/09763021;4-[(4-Chlorobenzene-1-sulfonyl)amino]benzoic acid;Z45512278

Suppliers and Price of 4-{[(4-Chlorophenyl)sulfonyl]amino}benzoic acid

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

Absolute Chiral
4-((4-chlorophenyl)sulfonamido)benzoicacid 95%
250 mg
$ 228.00

Total 0 raw suppliers

Chemical Property of 4-{[(4-Chlorophenyl)sulfonyl]amino}benzoic acid

Chemical Property:

PSA：91.85000
LogP:3.99280
XLogP3:2.9
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:4
Exact Mass:311.0019067
Heavy Atom Count:20
Complexity:432

Purity/Quality:: 4-((4-chlorophenyl)sulfonamido)benzoicacid 95% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=CC(=CC=C1C(=O)O)NS(=O)(=O)C2=CC=C(C=C2)Cl

Technology Process of 4-{[(4-Chlorophenyl)sulfonyl]amino}benzoic acid

There total 5 articles about 4-{[(4-Chlorophenyl)sulfonyl]amino}benzoic acid 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: 96.0%

: 150-13-0,159246-81-8,8014-65-1
4-amino-benzoic acid

: 98-60-2
4-chlorobenzenesulfonyl chloride

: 63421-70-5
4-(4-chlorobenzenesulphonylamino)benzoic acid

Guidance literature:: With hydrogenchloride; sodium hydrogencarbonate; In water; at 20 ℃; for 4h; pH=9;
DOI:10.1007/s00044-016-1707-7

Reference yield:

: 327094-26-8
methyl 4-{[(4-chlorophenyl)sulfonyl]amino}benzoate

: 63421-70-5
4-(4-chlorobenzenesulphonylamino)benzoic acid

Guidance literature:: With potassium tert-butylate; water; In diethyl ether; at 0 - 20 ℃;
DOI:10.1021/jm900251a

Reference yield:

: 619-45-4
4-methoxycarbonyl aniline

: 63421-70-5
4-(4-chlorobenzenesulphonylamino)benzoic acid

Guidance literature:: Multi-step reaction with 2 steps

1.1: pyridine / 0 - 20 °C / Inert atmosphere

2.1: sodium hydroxide / acetone; water / 2 h

2.2: pH 2

With pyridine; sodium hydroxide; In water; acetone;