123439 <common-name>N-(2-Carboxyethyl)-3-[(perfluoro-1-oxononyl)amino]-N,N-dimethyl-1-propanaminium</common-name> <description>N-(2-Carboxyethyl)-3-[(perfluoro-1-oxononyl)amino]-N,N-dimethyl-1-propanaminium belongs to the quaternary ammonium salts, a subclass of organonitrogen compounds within the organic compounds. With an average molecular weight of 620.31 g/mol, N-(2-Carboxyethyl)-3-[(perfluoro-1-oxononyl)amino]-N,N-dimethyl-1-propanaminium is a heavy molecule. Its chemical formula is C17H18F17N2O3. This compound is associated with 13 recorded sources across various sectors. In the area of electrical and electronic equipment, it is found in or released from batteries, capacitors, cell phones, printed circuit boards, wires and cables, and one additional source. Within the healthcare, pharmaceuticals and veterinary products sector, it is linked to medical devices. In the energy, oil and gas sector as well as industrial manufacturing and chemical processing, it is found in lubricants. Other sources include food packaging from the food, food processing and cookware sector, and synthetic textiles, carpets and rugs from the textiles, leather and furnishings sector, along with one further sector. Recorded exposure routes for this substance include oral, inhalation, and touch.</description> <cas>119131-05-4</cas> <pubchem-id>138396257</pubchem-id> <chemical-formula>C17H18F17N2O3</chemical-formula> <weight>621.31</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">2026-04-06T06:48:33Z</created-at> <updated-at type="dateTime">2026-08-29T00:26:58Z</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>C[N+](C)(CCCN=C(/O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)CCC(O)=O</moldb-smiles> <moldb-formula>C17H18F17N2O3</moldb-formula> <moldb-inchi>InChI=1S/C17H17F17N2O3/c1-36(2,7-4-8(37)38)6-3-5-35-9(39)10(18,19)11(20,21)12(22,23)13(24,25)14(26,27)15(28,29)16(30,31)17(32,33)34/h3-7H2,1-2H3,(H-,35,37,38,39)/p+1</moldb-inchi> <moldb-inchikey>ZGBMFNJIPSRTBS-UHFFFAOYSA-O</moldb-inchikey> <moldb-average-mass type="decimal">620.307</moldb-average-mass> <moldb-mono-mass type="decimal">621.1045972</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>5.3</logp> <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>CHEM119332</chemdb-id> <dsstox-id>DTXSID70893340</dsstox-id> <toxcast-id nil="true"/> <stoff-ident-origin nil="true"/> <stoff-ident-id nil="true"/> <susdat-id>NS00111366</susdat-id> <iupac>N-(2-Carboxyethyl)-3-[(Z)-(2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,9-heptadecafluoro-1-hydroxynonylidene)amino]-N,N-dimethylpropan-1-aminium</iupac> <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>CED0093843</sync-id> <structure-inchikey>ZGBMFNJIPSRTBS-UHFFFAOYSA-O</structure-inchikey> <structure-fingerprint>800000020000100000800000002000000080000000000000080000000000000000000000000200000000000000000004000002000000000000000000000000000000000000000000000000000008004020000000000000000004000000000000000000010000010000000000000200000048000000000000080000000000000000000040000000000000000000000000000000000000000040000000000000010000000000000000000000000002000000000000040000000010000000000000000008000000000000000000400000021000000000000000408000000000000000000004000000000000000000010400800000000000000000080000000000</structure-fingerprint> <structure-pattern-fingerprint>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</structure-pattern-fingerprint> <structure-pickle type="binary" encoding="base64">776t3gAAAAAQAAAAAwAAAAAAAAAnAAAAJgAAAIABBgBgAAAAAQMHICIAAAAB BAYAYAAAAAEDBgBgAAAAAgIGAGAAAAACAgYAYAAAAAICBwAoAAAAAwMGACgA AAADBAgAaAAAAAMBAQYAIAAAAAQJACAAAAABCQAgAAAAAQYAIAAAAAQJACAA AAABCQAgAAAAAQYAIAAAAAQJACAAAAABCQAgAAAAAQYAIAAAAAQJACAAAAAB CQAgAAAAAQYAIAAAAAQJACAAAAABCQAgAAAAAQYAIAAAAAQJACAAAAABCQAg AAAAAQYAIAAAAAQJACAAAAABCQAgAAAAAQYAIAAAAAQJACAAAAABCQAgAAAA AQkAIAAAAAEGAGAAAAACAgYAYAAAAAICBgAoAAAAAwQIAGgAAAADAQEIACgA AAADAgsAAQABAgABAwADBAAEBQAFBgAGBygCBwggBwkACQoACQsACQwADA0A DA4ADA8ADxAADxEADxIAEhMAEhQAEhUAFRYAFRcAFRgAGBkAGBoAGBsAGxwA Gx0AGx4AHh8AHiAAHiEAASIAIiMAIyQAJCUgJCYoAkIAAAAAFwQAAAAAAAAA Fg== </structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T04:46:37Z</structure-indexed-at> </compound>