90358-27-3 Purity
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Specification
The PubChem CID for 2,2,2-Trichloroethoxysulfuryl-N-methylimidazolium triflate is 57355608.
The molecular formula of 2,2,2-Trichloroethoxysulfuryl-N-methylimidazolium triflate is C7H8Cl3F3N2O6S2.
The synonyms for 2,2,2-Trichloroethoxysulfuryl-N-methylimidazolium triflate are 903587-97-3 and 2,2,2-TRICHLOROETHOXYSULFURYL-N-METHYLIMIDAZOLIUM TRIFLATE.
The molecular weight of 2,2,2-Trichloroethoxysulfuryl-N-methylimidazolium triflate is 443.6 g/mol.
The component compounds of 2,2,2-Trichloroethoxysulfuryl-N-methylimidazolium triflate are CID 57355609 (2,2,2-Trichloroethyl 1-methylimidazole-2-sulfonate) and CID 62406 (Trifluoromethanesulfonic acid).
The IUPAC name of 2,2,2-Trichloroethoxysulfuryl-N-methylimidazolium triflate is 2,2,2-trichloroethyl 1-methyl-1H-imidazol-l-ium-2-sulfonate;trifluoromethanesulfonate.
The InChI of 2,2,2-Trichloroethoxysulfuryl-N-methylimidazolium triflate is InChI=1S/C6H7Cl3N2O3S.CHF3O3S/c1-11-3-2-10-5(11)15(12,13)14-4-6(7,8)9;2-1(3,4)8(5,6)7/h2-3H,4H2,1H3;(H,5,6,7).
The InChIKey of 2,2,2-Trichloroethoxysulfuryl-N-methylimidazolium triflate is NMJLTKKCQMCERO-UHFFFAOYSA-N.
The canonical SMILES of 2,2,2-Trichloroethoxysulfuryl-N-methylimidazolium triflate is C[NH+]1C=CN=C1S(=O)(=O)OCC(Cl)(Cl)Cl.C(F)(F)(F)S(=O)(=O)[O-].
Yes, 2,2,2-Trichloroethoxysulfuryl-N-methylimidazolium triflate is the canonical form.