1-tert-Butyl-3-(ethylsulfanyl)benzene

Base Information

Chemical Name:1-tert-Butyl-3-(ethylsulfanyl)benzene
CAS No.:88315-69-9
Molecular Formula:C₁₂H₁₈S
Molecular Weight:194.341
Hs Code.:
DSSTox Substance ID:DTXSID00530958
Wikidata:Q82402447

Synonyms:88315-69-9;1-tert-Butyl-3-(ethylsulfanyl)benzene;3-tert-Butylphenyl ethyl sulfide;1-tert-butyl-3-ethylsulfanylbenzene;DTXSID00530958;AKOS006318445

Suppliers and Price of 1-tert-Butyl-3-(ethylsulfanyl)benzene

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

Rieke Metals
1-tert-BUTYL-3-(ETHYLSULFANYL)BENZENE
5g
$ 1943.00

Rieke Metals
1-tert-BUTYL-3-(ETHYLSULFANYL)BENZENE
1g
$ 809.00

Total 0 raw suppliers

Chemical Property of 1-tert-Butyl-3-(ethylsulfanyl)benzene

Chemical Property:

PSA：25.30000
LogP:4.09610
XLogP3:4.5
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:3
Exact Mass:194.11292175
Heavy Atom Count:13
Complexity:146

Purity/Quality:: 1-tert-BUTYL-3-(ETHYLSULFANYL)BENZENE ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCSC1=CC=CC(=C1)C(C)(C)C

Technology Process of 1-tert-Butyl-3-(ethylsulfanyl)benzene

There total 2 articles about 1-tert-Butyl-3-(ethylsulfanyl)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:

: 585-34-2
3-tert-butylphenyol

: 88315-69-9
Ethyl 3-tert-Butylphenyl Sulfide

Guidance literature:: Multi-step reaction with 2 steps

1: 30 percent / Ph₃PBr₂ / 340 °C

2: 1) Mg, I₂; 2) sulfur; 3) LiAlH₄ / 1) THF, reflux, 3 h; 2) reflux, 45 min; 3) reflux, 30 min; 4) MeOH, reflux, 30 min

With lithium aluminium tetrahydride; iodine; sulfur; magnesium; triphenylphosphine dibromide 1:1 addition complex;
DOI:10.1021/jo00179a033

Reference yield:

: 74-96-4
ethyl bromide

: 3972-64-3
1-bromo-3-(tertbutyl)benzene

: 88315-69-9
Ethyl 3-tert-Butylphenyl Sulfide

Guidance literature:: With lithium aluminium tetrahydride; iodine; sulfur; magnesium; Yield given. Multistep reaction; 1) THF, reflux, 3 h; 2) reflux, 45 min; 3) reflux, 30 min; 4) MeOH, reflux, 30 min;
DOI:10.1021/jo00179a033

Reference yield:

: 88315-69-9
Ethyl 3-tert-Butylphenyl Sulfide

: 88315-72-4
Ethyl 3-tert-Butylphenyl Sulfone

Guidance literature:: With potassium permanganate; magnesium sulfate; In tert-butyl alcohol; for 4h; Ambient temperature;
DOI:10.1021/jo00179a033