{[(Trifluoromethyl)thio]ethynyl}benzene

Base Information

Chemical Name:{[(Trifluoromethyl)thio]ethynyl}benzene
CAS No.:2002-89-3
Molecular Formula:C₉H₅F₃S
Molecular Weight:202.2
Hs Code.:
DSSTox Substance ID:DTXSID901269505
Nikkaji Number:J3.101.869B

Synonyms:{[(trifluoromethyl)thio]ethynyl}benzene;DTXSID901269505;1-(Trifluoromethylthio)-2-phenylethyne;[2-[(Trifluoromethyl)thio]ethynyl]benzene;benzene, [[(trifluoromethyl)thio]ethynyl]-;2002-89-3

Suppliers and Price of {[(Trifluoromethyl)thio]ethynyl}benzene

Supply Marketing:

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

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Chemical Property of {[(Trifluoromethyl)thio]ethynyl}benzene

Chemical Property:

XLogP3:4.2
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:2
Exact Mass:202.00640582
Heavy Atom Count:13
Complexity:214

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:C1=CC=C(C=C1)C#CSC(F)(F)F

Technology Process of {[(Trifluoromethyl)thio]ethynyl}benzene

There total 29 articles about {[(Trifluoromethyl)thio]ethynyl}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: 91.0%

: 811-68-7
silver(I) trifluoromethanethiolate

: 536-74-3
phenylacetylene

: 2002-89-3
{2-[(trifluoromethyl)sulfanyl]ethynyl}benzene

Guidance literature:: With potassium phosphate; N-chloro-succinimide; In N,N-dimethyl acetamide; at 20 ℃; Reagent/catalyst; Solvent; Inert atmosphere;
DOI:10.1002/ejoc.201402533

Reference yield: 84.0%

: 1-trifluoromethylthio-1,3-dihydro-3,3-dimethyl-1,2-benziodoxole

: 536-74-3
phenylacetylene

: 2002-89-3
{2-[(trifluoromethyl)sulfanyl]ethynyl}benzene

Guidance literature:: With [2,2]bipyridinyl; copper(I) bromide dimethylsulfide complex; potassium carbonate; In 1,2-dichloro-ethane; at 80 ℃; for 14h; Reagent/catalyst; Solvent; Temperature; Schlenk technique; Inert atmosphere;
DOI:10.1002/anie.201209817

Reference yield: 82.0%

: N,4-dimethyl-N-[(trifluoromethyl)-sulfanyl]benzene-1-sulfonamide

: 536-74-3
phenylacetylene

: 2002-89-3
{2-[(trifluoromethyl)sulfanyl]ethynyl}benzene

Guidance literature:: With [2,2]bipyridinyl; copper(l) iodide; In acetonitrile; at 20 ℃; for 20h; Reagent/catalyst;
DOI:10.1002/chem.201601338