66545552 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 16 9 9 9 9 9 8 8 8 7 7 6 6 6 6 6 6 1 1 1 1 1 1 1 7 -1 11 1 1 1 1 1 2 3 4 5 6 10 10 10 11 11 11 12 13 13 14 15 16 16 16 7 8 9 17 15 15 17 17 17 12 13 15 12 14 16 18 14 19 20 21 22 23 24 1 2 2 1 1 1 1 1 1 1 1 1 2 1 1 1 2 1 1 1 1 1 1 1 5 255 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 1.061 0.5326 2.2647 2.7931 2.427 1.427 0.195 0.561 1.561 1.3987 1.8987 2.2077 0.5897 0.8987 1.3987 2.4865 1.927 2.7973 0 0.5342 1.9356 2.988 2.8509 1.9849 0.866 4.232 4.232 1.866 0.5 2.232 0.366 1.732 0 5.732 7.2709 6.3198 6.3198 7.2709 4.732 8.0799 1.366 6.1283 6.1283 7.7725 5.042 7.7155 8.5815 8.4443 8 8 8 8 8 10 10 11 11 13 12 13 12 14 14 0 Compound Canonicalized 5 2012.05.21 1 Compound Complexity 7 E_COMPLEXITY 3.4.6.11 Cactvs xemistry.com 2019.06.18 242 Count Hydrogen Bond Acceptor 5 E_NHACCEPTORS 3.4.6.11 Cactvs xemistry.com 2019.06.18 8 Count Hydrogen Bond Donor 5 E_NHDONORS 3.4.6.11 Cactvs xemistry.com 2019.06.18 0 Count Rotatable Bond 5 E_NROTBONDS 3.4.6.11 Cactvs xemistry.com 2019.06.18 1 Fingerprint SubStructure Keys 16 extended 2 E_SCREEN 3.4.6.11 Cactvs xemistry.com 2019.06.18 00000371806331C0400000000000000000000000000160000000000000000000000000018000001D04000000000000C102142F90170C1002A0001027647000802D1112A00940001830008048000008001000000800020000200000000000000000000000000000000000000000000000000000 IUPAC Name Allowed 1 2.6.6 LexiChem openeye.com 2019.06.18 1-(difluoromethyl)-3-methyl-imidazol-3-ium;trifluoromethanesulfonate IUPAC Name CAS-like Style 1 2.6.6 LexiChem openeye.com 2019.06.18 1-(difluoromethyl)-3-methylimidazol-3-ium;trifluoromethanesulfonate IUPAC Name Markup 1 2.6.6 LexiChem openeye.com 2019.06.18 1-(difluoromethyl)-3-methylimidazol-3-ium;trifluoromethanesulfonate IUPAC Name Preferred 1 2.6.6 LexiChem openeye.com 2019.06.18 1-(difluoromethyl)-3-methylimidazol-3-ium;trifluoromethanesulfonate IUPAC Name Systematic 1 2.6.6 LexiChem openeye.com 2019.06.18 1-[bis(fluoranyl)methyl]-3-methyl-imidazol-3-ium;tris(fluoranyl)methanesulfonate IUPAC Name Traditional 1 2.6.6 LexiChem openeye.com 2019.06.18 1-(difluoromethyl)-3-methyl-imidazol-3-ium;triflate InChI Standard 1 1.0.5 InChI iupac.org 2019.06.18 InChI=1S/C5H7F2N2.CHF3O3S/c1-8-2-3-9(4-8)5(6)7;2-1(3,4)8(5,6)7/h2-5H,1H3;(H,5,6,7)/q+1;/p-1 InChIKey Standard 1 1.0.5 InChI iupac.org 2019.06.18 MPDFYHHVWAMLII-UHFFFAOYSA-M Mass Exact 1 2.1 PubChem ncbi.nlm.nih.gov 2021.05.07 282.00975407 Molecular Formula 1 2.1 PubChem ncbi.nlm.nih.gov 2019.06.18 C6H7F5N2O3S Molecular Weight 1 2.1 PubChem ncbi.nlm.nih.gov 2021.05.07 282.19 SMILES Canonical 1 2.1.5 OEChem openeye.com 2019.06.18 C[N+]1=CN(C=C1)C(F)F.C(F)(F)(F)S(=O)(=O)[O-] SMILES Isomeric 1 2.1.5 OEChem openeye.com 2019.06.18 C[N+]1=CN(C=C1)C(F)F.C(F)(F)(F)S(=O)(=O)[O-] Topological Polar Surface Area 7 E_TPSA 3.4.6.11 Cactvs xemistry.com 2019.06.18 74.4 Weight MonoIsotopic 1 2.1 PubChem ncbi.nlm.nih.gov 2021.05.07 282.00975407 17 0 0 0 0 0 0 0 2 -1