4-(Cyclohexylsulfamoyl)benzoic acid

Base Information

Chemical Name:4-(Cyclohexylsulfamoyl)benzoic acid
CAS No.:6314-70-1
Molecular Formula:C13H17NO4S
Molecular Weight:283.348
Hs Code.:
NSC Number:23005
DSSTox Substance ID:DTXSID30281769
Nikkaji Number:J1.395.737A
Wikidata:Q82015837
ChEMBL ID:CHEMBL1537813
Mol file:6314-70-1.mol

Synonyms:4-(cyclohexylsulfamoyl)benzoic acid;6314-70-1;NSC23005;NSC 23005;4-[(Cyclohexylamino)sulfonyl]benzoic acid;4-Cyclohexylsulfamoyl-benzoic acid;Oprea1_448078;MLS000070179;CHEMBL1537813;SCHEMBL16197620;DTXSID30281769;XGOXPTXOQXHIDL-UHFFFAOYSA-N;HMS2479F20;p-(Cyclohexylsulfamoyl)benzoic acid;BCP24806;EX-A1227;NSC-23005;4-(N-cyclohexylsulfamoyl)benzoic acid;AKOS000165940;AC-35408;SMR000011719;4-[(Cyclohexylamino)sulfonyl]benzoic acid #;A935038

Suppliers and Price of 4-(Cyclohexylsulfamoyl)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

DC Chemicals
NSC23005freeacid >98%
100 mg
$ 350.00

DC Chemicals
NSC23005freeacid >98%
1 g
$ 1200.00

American Custom Chemicals Corporation
4-(CYCLOHEXYLSULFAMOYL)BENZOIC ACID 95.00%
5MG
$ 498.92

Total 14 raw suppliers

Chemical Property of 4-(Cyclohexylsulfamoyl)benzoic acid

Chemical Property:

Vapor Pressure:9.13E-10mmHg at 25°C
Boiling Point:473.4°C at 760 mmHg
Flash Point:240.1°C
PSA：91.85000
Density:1.36g/cm³
LogP:3.46750
XLogP3:2.2
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:4
Exact Mass:283.08782920
Heavy Atom Count:19
Complexity:401

Purity/Quality:

99%, ^*data from raw suppliers

NSC23005freeacid >98% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1CCC(CC1)NS(=O)(=O)C2=CC=C(C=C2)C(=O)O

Technology Process of 4-(Cyclohexylsulfamoyl)benzoic acid

There total 4 articles about 4-(Cyclohexylsulfamoyl)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: 81.8%

: 6314-70-1
4-(cyclohexylamino-1-sulfonyl)benzoic acid

Guidance literature:: With water; sodium hydroxide; In N,N-dimethyl-formamide; at 80 ℃; for 4h;

Reference yield: 68.0%

: 10130-89-9
p-carboxyphenylsulfonyl chloride

: 108-91-8,157973-60-9
cyclohexylamine

: 6314-70-1
4-(cyclohexylamino-1-sulfonyl)benzoic acid

Guidance literature:: With sodium hydroxide; In water; at 20 ℃; for 16h;

Reference yield:

: 10486-51-8
4-ethoxycarbonylbenzenesulfonyl chloride

: 6314-70-1
4-(cyclohexylamino-1-sulfonyl)benzoic acid

Guidance literature:: Multi-step reaction with 2 steps

1: triethylamine / dichloromethane / 5 h / 20 °C / Inert atmosphere; Cooling with ice

2: lithium hydroxide monohydrate / methanol; water / 2 h / 20 °C

With lithium hydroxide monohydrate; triethylamine; In methanol; dichloromethane; water;
DOI:10.1016/j.ejmech.2022.114145