Organofluorine / Alfa Chemistry
1-((2-((8-chloro-1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8-hexadecafluorooctyl)oxy)-1,1,2,2-tetrafluoroethyl)sulfonyl)-3-methyl-2-phenyl-1H-imidazol-3-ium trifluoromethanesulfonate

1-((2-((8-chloro-1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8-hexadecafluorooctyl)oxy)-1,1,2,2-tetrafluoroethyl)sulfonyl)-3-methyl-2-phenyl-1H-imidazol-3-ium trifluoromethanesulfonate

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1-((2-((8-chloro-1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8-hexadecafluorooctyl)oxy)-1,1,2,2-tetrafluoroethyl)sulfonyl)-3-methyl-2-phenyl-1H-imidazol-3-ium trifluoromethanesulfonate
Catalog OFC01212
Category Trifluoromethylthiolation Agents
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Other Identifiers Chemical Data Computational Chemistry
InChI InChI=1S/C20H10ClF20N2O3S.CHF3O3S/c1-42-7-8-43(10(42)9-5-3-2-4-6-9)47(44,45)20(40,41)19(38,39)46-18(36,37)16(32,33)14(28,29)12(24,25)11(22,23)13(26,27)15(30,31)17(21,34)35;2-1(3,4)8(5,6)7/h2-8H,1H3;(H,5,6,7)/q+1;/p-1
InChI Key HAPAURVEONSOSF-UHFFFAOYSA-M
Canonical SMILES C[n+]1ccn(S(=O)(=O)C(F)(F)C(F)(F)OC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)Cl)c1-c1ccccc1.O=S(=O)([O-])C(F)(F)F
Molecular Formula C21H10ClF23N2O6S2
Molecular Weight 922.86
Appearance white solid
Exact Mass 921.9302

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