13009 <common-name>1H-Imidazolium, 3-ethyl-1-methyl-, ethyl sulfate (1:1)</common-name> <description nil="true"/> <cas>342573-75-5</cas> <pubchem-id>12095229</pubchem-id> <chemical-formula>C8H16N2O4S</chemical-formula> <weight>236.29</weight> <appearance nil="true"/> <melting-point nil="true"/> <boiling-point nil="true"/> <density nil="true"/> <solubility nil="true"/> <specific-gravity nil="true"/> <flash-point nil="true"/> <vapour-pressure nil="true"/> <route-of-exposure nil="true"/> <target nil="true"/> <mechanism-of-toxicity nil="true"/> <metabolism nil="true"/> <toxicity nil="true"/> <lethaldose nil="true"/> <carcinogenicity nil="true"/> <use-source nil="true"/> <min-risk-level nil="true"/> <health-effects nil="true"/> <symptoms nil="true"/> <treatment nil="true"/> <created-at type="dateTime">2016-05-19T03:46:43Z</created-at> <updated-at type="dateTime">2026-04-17T16:52:57Z</updated-at> <interacting-proteins nil="true"/> <wikipedia nil="true"/> <uniprot-id nil="true"/> <kegg-compound-id nil="true"/> <omim-id nil="true"/> <chebi-id nil="true"/> <biocyc-id nil="true"/> <ctd-id nil="true"/> <stitch-id nil="true"/> <drugbank-id nil="true"/> <pdb-id nil="true"/> <actor-id nil="true"/> <organism nil="true"/> <export type="boolean">true</export> <metabolizing-proteins nil="true"/> <transporting-proteins nil="true"/> <moldb-smiles>CCOS([O-])(=O)=O.CCN1C=C[N+](C)=C1</moldb-smiles> <moldb-formula>C8H16N2O4S</moldb-formula> <moldb-inchi>InChI=1S/C6H11N2.C2H6O4S/c1-3-8-5-4-7(2)6-8;1-2-6-7(3,4)5/h4-6H,3H2,1-2H3;2H2,1H3,(H,3,4,5)/q+1;/p-1</moldb-inchi> <moldb-inchikey>VRFOKYHDLYBVAL-UHFFFAOYSA-M</moldb-inchikey> <moldb-average-mass type="decimal">236.29</moldb-average-mass> <moldb-mono-mass type="decimal">236.083078177</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp nil="true"/> <hmdb-id nil="true"/> <chembl-id nil="true"/> <chemspider-id nil="true"/> <structure-image-file-name nil="true"/> <structure-image-content-type nil="true"/> <structure-image-file-size type="integer" nil="true"/> <structure-image-updated-at type="dateTime" nil="true"/> <biodb-id nil="true"/> <synthesis-reference nil="true"/> <structure-image-caption nil="true"/> <chemdb-id>CHEM011904</chemdb-id> <dsstox-id nil="true"/> <toxcast-id nil="true"/> <stoff-ident-origin nil="true"/> <stoff-ident-id nil="true"/> <susdat-id>NS00078602</susdat-id> <iupac nil="true"/> <moldb-polar-surface-area>8.809999999999999</moldb-polar-surface-area> <moldb-refractivity>33.601299999999995</moldb-refractivity> <moldb-polarizability>13.03886569074974</moldb-polarizability> <moldb-rotatable-bond-count>3</moldb-rotatable-bond-count> <moldb-acceptor-count>0</moldb-acceptor-count> <moldb-donor-count>0</moldb-donor-count> <moldb-pka-strongest-acidic nil="true"/> <moldb-pka-strongest-basic nil="true"/> <moldb-physiological-charge>1</moldb-physiological-charge> <moldb-number-of-rings>1</moldb-number-of-rings> <moldb-alogps-logp>-2.51</moldb-alogps-logp> <moldb-alogps-logs>-2.07</moldb-alogps-logs> <moldb-alogps-solubility>2.03e+00 g/l</moldb-alogps-solubility> </compound>