Benzene, 1-(1-octynyl)-4-(trifluoromethyl)-

Base Information

Chemical Name:Benzene, 1-(1-octynyl)-4-(trifluoromethyl)-
CAS No.:536973-41-8
Molecular Formula:C15H17F3
Molecular Weight:254.295
Hs Code.:
DSSTox Substance ID:DTXSID00468782
Nikkaji Number:J2.118.792E
Wikidata:Q82296182
Mol file:536973-41-8.mol

Synonyms:Benzene, 1-(1-octynyl)-4-(trifluoromethyl)-;536973-41-8;DTXSID00468782

Suppliers and Price of Benzene, 1-(1-octynyl)-4-(trifluoromethyl)-

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
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price

Total 1 raw suppliers

Chemical Property of Benzene, 1-(1-octynyl)-4-(trifluoromethyl)-

Chemical Property:

XLogP3:6.2
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:5
Exact Mass:254.12823503
Heavy Atom Count:18
Complexity:284

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCCCCCC#CC1=CC=C(C=C1)C(F)(F)F

Technology Process of Benzene, 1-(1-octynyl)-4-(trifluoromethyl)-

There total 6 articles about Benzene, 1-(1-octynyl)-4-(trifluoromethyl)- 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: 97.0%

: 629-05-0
n-octyne

: 98-56-6
4-chlorobenzotrifluoride

: 536973-41-8
1-(oct-1-yn-1-yl)-4-(trifluoromethyl)benzene

Guidance literature:: With dichloro bis(acetonitrile) palladium(II); 2-(di-tert-butylphosphino)-1-(2,6-diisopropylphenyl)-1H-imidazole; sodium carbonate; In toluene; at 90 ℃; Inert atmosphere;
DOI:10.1002/chem.200802444

Reference yield: 92.0%

: 629-05-0
n-octyne

: 402-43-7
p-trifluoromethylphenyl bromide

: 536973-41-8
1-(oct-1-yn-1-yl)-4-(trifluoromethyl)benzene

Guidance literature:: With Cu[9,9-dimethyl-4,5-bis(diphenylphosphine)xanthene]I; palladium diacetate; caesium carbonate; In N,N-dimethyl-formamide; at 60 ℃; for 16h; Inert atmosphere;
DOI:10.1016/j.tetlet.2016.06.014

Reference yield: 88.0%

: 629-05-0
n-octyne

: 143028-36-8
4,4'-sulfinylbis((trifluoromethyl)benzene)

: 536973-41-8
1-(oct-1-yn-1-yl)-4-(trifluoromethyl)benzene

Guidance literature:: With dichloro-[1,3-bis(2,6-diisopropylpenyl)-2-imidazolidinyliden]-(3-chloropyridyl)palladium(II); lithium tert-butoxide; In tetrahydrofuran; at 70 ℃; for 6h; Schlenk technique; Inert atmosphere;
DOI:10.1055/s-0036-1591676