Organofluorine / Alfa Chemistry
3-methyl-1-((perfluorooctyl)sulfonyl)-2-phenyl-1H-imidazol-3-ium trifluoromethanesulfonate

3-methyl-1-((perfluorooctyl)sulfonyl)-2-phenyl-1H-imidazol-3-ium trifluoromethanesulfonate

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3-methyl-1-((perfluorooctyl)sulfonyl)-2-phenyl-1H-imidazol-3-ium trifluoromethanesulfonate
Catalog OFC01216
Category Trifluoromethylthiolation Agents
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Other Identifiers Chemical Data Computational Chemistry
InChI InChI=1S/C18H10F17N2O2S.CHF3O3S/c1-36-7-8-37(10(36)9-5-3-2-4-6-9)40(38,39)18(34,35)16(29,30)14(25,26)12(21,22)11(19,20)13(23,24)15(27,28)17(31,32)33;2-1(3,4)8(5,6)7/h2-8H,1H3;(H,5,6,7)/q+1;/p-1
InChI Key GGTCWDGTGVJGOF-UHFFFAOYSA-M
Canonical SMILES C[n+]1ccn(S(=O)(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)c1-c1ccccc1.O=S(=O)([O-])C(F)(F)F
Molecular Formula C19H10F20N2O5S2
Molecular Weight 790.392
Appearance white solid
Exact Mass 789.9712

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