100284 <common-name>Bis(2-hydroxyethyl)(3-sulphonatopropyl)tetradecylammonium</common-name> <description>Bis(2-hydroxyethyl)(3-sulphonatopropyl)tetradecylammonium belongs to the quaternary ammonium salts, a subclass of organonitrogen compounds within the organic compounds. This compound has the formula C21H46NO5S and an average molecular weight of 423.65 g/mol. It is further classified as an organic nitrogen compound.</description> <cas>93841-10-2</cas> <pubchem-id>21149732</pubchem-id> <chemical-formula>C21H46NO5S</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">2026-04-05T07:39:04Z</created-at> <updated-at type="dateTime">2026-04-05T07:39:04Z</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>CCCCCCCCCCCCCC[N+](CCO)(CCO)CCCS([O-])(=O)=O</moldb-smiles> <moldb-formula>C21H46NO5S</moldb-formula> <moldb-inchi>InChI=1/C21H45NO5S/c1-2-3-4-5-6-7-8-9-10-11-12-13-15-22(17-19-23,18-20-24)16-14-21-28(25,26)27/h23-24H,2-21H2,1H3</moldb-inchi> <moldb-inchikey>WGCAVZRGIFXOPL-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal">423.65</moldb-average-mass> <moldb-mono-mass type="decimal">424.3096696</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>CHEM096177</chemdb-id> <dsstox-id>DTXSID60239758</dsstox-id> <toxcast-id nil="true"/> <stoff-ident-origin nil="true"/> <stoff-ident-id nil="true"/> <susdat-id>NS00063303</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>CED0160609</sync-id> <structure-inchikey>WGCAVZRGIFXOPL-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>800000000400000000000000000000000002000000000000000002000000000004020000001000000002000000000000004040000000000000010000000000010000000002000020000000000000001000000000000000000020010000000000000000000000000040000000200000000000000000000000000040000000000000000000010000000000000000000000000000000000000000048000000000000000000000000000000008000000080000000000040000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000010000000000000000000000000040000000</structure-fingerprint> <structure-pattern-fingerprint>500000008112020081000100010820000000040000052000203000408200080c4402005000900000000041000080000004600005008c10010000643000a04000c6110400008004030090100000f20000000404804019083240000422400001000c3001220048020040000000d53c0040204080500101e0041198000002100002104000080eec80080c020240082c0008111c0812440014020300080000424080404310000010c00000000840016c25100ac00000880108001000021008400200801000a404800022008000000441028000000000020041000d0000000800020000000810000000000000000100122000005000308042000cc000000050000002</structure-pattern-fingerprint> <structure-pickle>ï¾­Þ������������������������€���`�������`�������`�������`�������`�������`�������`�������`�������`�������`�������`�������`�������`�������`������ "�������`�������`�������`�������`�������`�������`�������`�������`�������`������� ����� "���ÿ���(�������(������������������������������� � � ������ � �������������������������������������������B��������������</structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T04:39:11Z</structure-indexed-at> </compound>