4'-Methyl[1,1'-biphenyl]-4-sulfonic acid

Base Information

Chemical Name:4'-Methyl[1,1'-biphenyl]-4-sulfonic acid
CAS No.:91903-24-1
Molecular Formula:C₁₃H₁₂O₃S
Molecular Weight:248.302
Hs Code.:
DSSTox Substance ID:DTXSID50448493
Nikkaji Number:J1.341.536F
Wikidata:Q82267506
Mol file:91903-24-1.mol

Synonyms:91903-24-1;4'-Methyl[1,1'-biphenyl]-4-sulfonic acid;SCHEMBL2894715;4-Methyl-4-biphenylsulfonic acid;DTXSID50448493;4'-Methylbiphenyl-4-sulfonic acid;AKOS015966281

Suppliers and Price of 4'-Methyl[1,1'-biphenyl]-4-sulfonic 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

American Custom Chemicals Corporation
4'-METHYL-4-BIPHENYLSULFONIC ACID 95.00%
5MG
$ 503.91

Total 3 raw suppliers

Chemical Property of 4'-Methyl[1,1'-biphenyl]-4-sulfonic acid

Chemical Property:

PSA：62.75000
LogP:3.98950
XLogP3:2.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:248.05071541
Heavy Atom Count:17
Complexity:328

Purity/Quality:: 4'-METHYL-4-BIPHENYLSULFONIC ACID 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)C2=CC=C(C=C2)S(=O)(=O)O

Technology Process of 4'-Methyl[1,1'-biphenyl]-4-sulfonic acid

There total 3 articles about 4'-Methyl[1,1'-biphenyl]-4-sulfonic 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: 55.0%

: 5720-05-8
4-methylphenylboronic acid

: 91903-24-1
4'-methylbiphenyl-4-sulfonic acid

Guidance literature:: 4-methylphenylboronic acid; 4-iodobenzenesulfonate-functionalized Argogel-MBOH resin; With potassium carbonate; tris-(dibenzylideneacetone)dipalladium⁽⁰⁾; In dichloromethane; N,N-dimethyl-formamide; for 2h; Heating;

With trifluoroacetic acid; In dichloromethane; for 1h; Further stages.;
DOI:10.1021/ol991163z

Reference yield:

: 644-08-6
4-Methylbiphenyl

: 91903-24-1
4'-methylbiphenyl-4-sulfonic acid

Guidance literature:: With sulfuric acid;

Reference yield:

: 138-36-3
p-bromobenzene sulfonic acid

: 5720-05-8
4-methylphenylboronic acid

: 91903-24-1
4'-methylbiphenyl-4-sulfonic acid

Guidance literature:: With (1,1'-bis(diphenylphosphino)ferrocene)palladium(II) dichloride; potassium carbonate; In 1,2-dimethoxyethane; water; at 80 ℃; for 3.5h; Inert atmosphere;
DOI:10.1021/jm801394m