24412 1 2 3 4 5 6 7 8 9 10 11 12 19 19 16 16 8 8 8 8 8 8 8 8 1 1 2 1 7 -1 8 -1 3 3 3 3 4 4 4 4 5 5 7 9 10 6 8 11 12 6 1 1 2 2 1 1 2 2 1 1 5 255 1 2 3 4 5 6 7 8 9 10 11 12 2 8.0622 3.732 6.3301 4.5981 5.4641 2.866 7.1962 3.232 4.232 6.8301 5.8301 -0.25 0.25 -0.25 0.25 0.25 -0.25 -0.75 0.75 0.616 -1.116 -0.616 1.116 0 Compound Canonicalized 5 2021.10.14 1 Compound Complexity 7 E_COMPLEXITY 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 206 Count Hydrogen Bond Acceptor 5 E_NHACCEPTORS 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 8 Count Hydrogen Bond Donor 5 E_NHDONORS 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 0 Count Rotatable Bond 5 E_NROTBONDS 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 1 Fingerprint SubStructure Keys 16 extended 2 E_SCREEN 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 0000037100003C006060000000000000000000000000000000000000000000000000000000000000000004000000000000000000000000000000000000300000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000 IUPAC Name Allowed 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 dipotassium;sulfonatooxy sulfate IUPAC Name CAS-like Style 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 dipotassium;sulfonatooxy sulfate IUPAC Name Markup 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 dipotassium;sulfonatooxy sulfate IUPAC Name Preferred 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 dipotassium;sulfonatooxy sulfate IUPAC Name Systematic 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 dipotassium;sulfonatooxy sulfate IUPAC Name Traditional 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 dipotassium;sulfato sulfate InChI Standard 1 1.0.6 InChI iupac.org 2021.10.14 InChI=1S/2K.H2O8S2/c;;1-9(2,3)7-8-10(4,5)6/h;;(H,1,2,3)(H,4,5,6)/q2*+1;/p-2 InChIKey Standard 1 1.0.6 InChI iupac.org 2021.10.14 USHAGKDGDHPEEY-UHFFFAOYSA-L Mass Exact 1 2.2 PubChem ncbi.nlm.nih.gov 2021.10.14 269.8308723 Molecular Formula 1 2.2 PubChem ncbi.nlm.nih.gov 2021.10.14 K2O8S2 Molecular Weight 1 2.2 PubChem ncbi.nlm.nih.gov 2021.10.14 270.33 SMILES Canonical 1 2.3.0 OEChem OpenEye Scientific Software 2021.10.14 [O-]S(=O)(=O)OOS(=O)(=O)[O-].[K+].[K+] SMILES Isomeric 1 2.3.0 OEChem OpenEye Scientific Software 2021.10.14 [O-]S(=O)(=O)OOS(=O)(=O)[O-].[K+].[K+] Topological Polar Surface Area 7 E_TPSA 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 150 Weight MonoIsotopic 1 2.2 PubChem ncbi.nlm.nih.gov 2021.10.14 269.8308723 12 0 0 0 0 0 0 0 3 -1