S-(Trifluoromethyl)dibenzothiophenium tetrafluoroborate

Base Information

• Chemical Name: S-(Trifluoromethyl)dibenzothiophenium tetrafluoroborate
• CAS No.: 131880-16-5
• Molecular Formula: C13H8BF7S
• Molecular Weight: 340.07
• Hs Code.: 29349990
• European Community (EC) Number: 806-503-9
• DSSTox Substance ID: DTXSID50380541
• Mol file: 131880-16-5.mol

Synonyms:131880-16-5;5-(Trifluoromethyl)dibenzothiophenium tetrafluoroborate;S-(Trifluoromethyl)dibenzothiophenium tetrafluoroborate;5-(Trifluoromethyl)-5H-dibenzo[b,d]thiophen-5-ium tetrafluoroborate;5-(trifluoromethyl)dibenzothiophen-5-ium;tetrafluoroborate;5-(Trifluoromethyl)dibenzothiopheniumtetrafluoroborate;MFCD01073545;C13H8BF7S;SCHEMBL629520;DTXSID50380541;AKOS016004863;Dibenzothiophenium, 5-(trifluoromethyl)-, tetrafluoroborate(1-) (1:1);GS-3654;SY029820;AM20020393;FT-0643168;5-trifluoromethyldibenzothiophenium tetrafluoroborate;J-006077;5-(trifluoromethyl)dibenzo[b,d]thiophenium tetrafluoroborate;5-(Trifluoromethyl)dibenzo[b,d]thiophen-5-ium tetrafluoroborate;5-(Trifluoromethyl)dibenzothiophenium tetrafluoroborate, 97%;5-(trifluoromethyl)-5H-dibenzo[b,d]thiophenium tetrafluoroborate;8-(trifluoromethyl)-8-thiatricyclo[7.4.0.0^{2,7}]trideca-1(9),2(7),3,5,10,12-hexaen-8-ium;tetrafluoroboranuide

Chemical Property of S-(Trifluoromethyl)dibenzothiophenium tetrafluoroborate

Chemical Property:

• Melting Point: 171-172 °C
• PSA: 25.30000
• LogP: 5.52310
• Storage Temp.: Keep in dark place,Inert atmosphere,Room temperature
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 0
• Exact Mass: 340.0327987
• Heavy Atom Count: 22
• Complexity: 286

Purity/Quality:

99% ^*data from raw suppliers

5-(Trifluoromethyl)dibenzothiophenium tetrafluoroborate ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi
• Safety Statements: 24/25

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: [B-](F)(F)(F)F.C1=CC=C2C(=C1)C3=CC=CC=C3[S+]2C(F)(F)F
• Uses: 5-(Trifluoromethyl)dibenzothiophenium Tetrafluoroborate is used to synthesize ortho-trifluoromethylated and ortho-(fluoro)alkylated pyridine derivatives. It is used as a CF3 source under visible light irradiation for the photoredox-catalyzed trifluoromethylation of electron rich alkene resulting in 1,3-bis(trifluoromethyl)-1-propenyl skeleton.