102760 <common-name>Triethyl[2-[(1-oxooctyl)oxy]ethyl]ammonium ethyl sulphate</common-name> <description>Triethyl[2-[(1-oxooctyl)oxy]ethyl]ammonium ethyl sulphate belongs to the quaternary ammonium salts, a subclass of organonitrogen compounds within the organic compounds. This compound has the chemical formula C16H34NO2 and an average molecular weight of 397.57 g/mol.</description> <cas>98072-08-3</cas> <pubchem-id>3025062</pubchem-id> <chemical-formula>C16H34NO2</chemical-formula> <weight nil="true"/> <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">2026-04-05T09:54:00Z</created-at> <updated-at type="dateTime">2026-04-05T09:54:00Z</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.CCCCCCCC(=O)OCC[N+](CC)(CC)CC</moldb-smiles> <moldb-formula>C16H34NO2</moldb-formula> <moldb-inchi>InChI=1/C16H34NO2.C2H6O4S/c1-5-9-10-11-12-13-16(18)19-15-14-17(6-2,7-3)8-4;1-2-6-7(3,4)5/h5-15H2,1-4H3;2H2,1H3,(H,3,4,5)/q+1;/p-1</moldb-inchi> <moldb-inchikey>UVMDHJDDPXKIIO-UHFFFAOYSA-M</moldb-inchikey> <moldb-average-mass type="decimal">397.57</moldb-average-mass> <moldb-mono-mass type="decimal">272.2589543</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>CHEM098653</chemdb-id> <dsstox-id>DTXSID10243421</dsstox-id> <toxcast-id nil="true"/> <stoff-ident-origin nil="true"/> <stoff-ident-id nil="true"/> <susdat-id>NS00066281</susdat-id> <iupac nil="true"/> <moldb-polar-surface-area nil="true"/> <moldb-refractivity nil="true"/> <moldb-polarizability nil="true"/> <moldb-rotatable-bond-count nil="true"/> <moldb-acceptor-count nil="true"/> <moldb-donor-count nil="true"/> <moldb-pka-strongest-acidic nil="true"/> <moldb-pka-strongest-basic nil="true"/> <moldb-physiological-charge nil="true"/> <moldb-number-of-rings nil="true"/> <moldb-alogps-logp nil="true"/> <moldb-alogps-logs nil="true"/> <moldb-alogps-solubility nil="true"/> <kingdom>Organic compounds</kingdom> <superklass>Organic nitrogen compounds</superklass> <klass>Organonitrogen compounds</klass> <subklass>Quaternary ammonium salts</subklass> <paper-count type="integer">0</paper-count> <sync-id>CED0120739</sync-id> <structure-inchikey>UVMDHJDDPXKIIO-UHFFFAOYSA-M</structure-inchikey> <structure-fingerprint>40000000000000000801000000800000010000000000000000000100000000000000002000000000000020000000000000002100800000000000000000000000000000000000000010000000000000020000004000110001000000000000000000030010000000000000000000000000040000000000000000000000000100020000040000000000000000000010000000000000000000000020000001000000100040000000000000000002001000000000008004000080000000000040000000008000000000000000000000000000000000000000000000000000000000000000000000000000000000000010400000000000000000000000000000000</structure-fingerprint> <structure-pattern-fingerprint>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</structure-pattern-fingerprint> <structure-pickle>ï¾­Þ������������������������€���`�������`������� ������ ����� "���ÿ���(�������(�������`�������`�������`�������`�������`�������`�������`�������(�������(�������(�������`�������`������ "�������`�������`�������`�������`�������`�������`������������������������������ � � ������ � ����(��� ���������������������������B��������������</structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T04:40:37Z</structure-indexed-at> </compound>