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| IUPAC Name: | 5-(trifluoromethyl)dibenzothiophen-5-ium;tetrafluoroborate |
| Description: | 5-(Trifluoromethyl)dibenzothiophenium tetrafluoroborate (CAS# 131880-16-5) 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. |
| Molecular Weight: | 340.07 |
| Molecular Formula: | C13H8BF7S |
| Canonical SMILES: | [B-](F)(F)(F)F.C1=CC=C2C(=C1)C3=CC=CC=C3[S+]2C(F)(F)F |
| InChI: | InChI=1S/C13H8F3S.BF4/c14-13(15,16)17-11-7-3-1-5-9(11)10-6-2-4-8-12(10)17;2-1(3,4)5/h1-8H;/q+1;-1 |
| InChI Key: | VTVISWLINKWMQZ-UHFFFAOYSA-N |
| Melting Point: | 171-172 °C |
| Purity: | 95 % |
| Appearance: | White to yellow powder, crystals and/or chunks |
| Storage: | Keep in dark place, Inert atmosphere, Room temperature |
| MDL: | MFCD01073545 |
| LogP: | 5.52310 |
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