Organofluorine / Alfa Chemistry
2-(4-fluorophenyl)-1-(fluorosulfonyl)-3-methyl-1H-benzo[d]imidazol-3-iumtrifluoromethanesulfonate

2-(4-fluorophenyl)-1-(fluorosulfonyl)-3-methyl-1H-benzo[d]imidazol-3-iumtrifluoromethanesulfonate

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2-(4-fluorophenyl)-1-(fluorosulfonyl)-3-methyl-1H-benzo[d]imidazol-3-iumtrifluoromethanesulfonate
Catalog OFC01213
Category Trifluoromethylthiolation Agents
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Other Identifiers Chemical Data Computational Chemistry
InChI InChI=1S/C14H11F2N2O2S.CHF3O3S/c1-17-12-4-2-3-5-13(12)18(21(16,19)20)14(17)10-6-8-11(15)9-7-10;2-1(3,4)8(5,6)7/h2-9H,1H3;(H,5,6,7)/q+1;/p-1
InChI Key DEOKZXVOHNIOAE-UHFFFAOYSA-M
Canonical SMILES C[n+]1c(-c2ccc(F)cc2)n(S(=O)(=O)F)c2ccccc21.O=S(=O)([O-])C(F)(F)F
Molecular Formula C15H11F5N2O5S2
Molecular Weight 458.386
Melting Point 148-149 °C
Appearance white solid
Exact Mass 458.003

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