1-Methyl-4-[1-(methylsulfanyl)tridecane-1-sulfonyl]benzene

Base Information

Chemical Name:1-Methyl-4-[1-(methylsulfanyl)tridecane-1-sulfonyl]benzene
CAS No.:87228-65-7
Molecular Formula:C21H36O2S2
Molecular Weight:384.648
Hs Code.:
DSSTox Substance ID:DTXSID20513940
Nikkaji Number:J2.937.499F

Synonyms:87228-65-7;SCHEMBL11036312;DTXSID20513940;1-Methyl-4-[1-(methylsulfanyl)tridecane-1-sulfonyl]benzene

Suppliers and Price of 1-Methyl-4-[1-(methylsulfanyl)tridecane-1-sulfonyl]benzene

Supply Marketing:

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

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Chemical Property of 1-Methyl-4-[1-(methylsulfanyl)tridecane-1-sulfonyl]benzene

Chemical Property:

XLogP3:8.5
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:14
Exact Mass:384.21567273
Heavy Atom Count:25
Complexity:406

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCCCCCCCCCCCC(SC)S(=O)(=O)C1=CC=C(C=C1)C

Technology Process of 1-Methyl-4-[1-(methylsulfanyl)tridecane-1-sulfonyl]benzene

There total 2 articles about 1-Methyl-4-[1-(methylsulfanyl)tridecane-1-sulfonyl]benzene 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%

: 59662-65-6
methylthiomethyl p-tolyl sulfone

: 143-15-7
1-dodecylbromide

: 87228-65-7
methyl(1-tosyltridecyl)sulfane

Guidance literature:: With Aliquat 336; In sodium hydroxide; toluene; at 60 ℃; for 24h;
DOI:10.1246/cl.1983.767

Reference yield:

: 824-79-3
sodium 4-methylbenzenesulfinate

: 87228-65-7
methyl(1-tosyltridecyl)sulfane

Guidance literature:: Multi-step reaction with 2 steps

1: 1.) acetic anhydride; 2.) acetic acid, sodium acetate / 1.) 80 deg C, 24 h; 2.) 100 deg C, 26 h

2: 96 percent / trioctylmethylammonium chloride / toluene; aq. NaOH / 24 h / 60 °C

With sodium acetate; acetic anhydride; Aliquat 336; acetic acid; In sodium hydroxide; toluene;
DOI:10.1246/cl.1983.767