315292 <common-name>3-(1-methylpiperidin-1-ium-1-yl)propyl 2,2,4,4-tetramethylpentanoate</common-name> <description>3-(1-methylpiperidin-1-ium-1-yl)propyl 2,2,4,4-tetramethylpentanoate is a compound with the formula C18H36NO2+. It has an average molecular weight of 298.50 g/mol.</description> <cas nil="true"/> <pubchem-id>214592</pubchem-id> <chemical-formula>C18H36NO2+</chemical-formula> <weight>298.5</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">2026-08-29T12:38:41Z</created-at> <updated-at type="dateTime">2026-08-29T12:38:41Z</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>CC(C)(C)CC(C)(C)C(=O)OCCC[N+]1(CCCCC1)C</moldb-smiles> <moldb-formula>C18H36NO2+</moldb-formula> <moldb-inchi>InChI=1S/C18H36NO2/c1-17(2,3)15-18(4,5)16(20)21-14-10-13-19(6)11-8-7-9-12-19/h7-15H2,1-6H3/q+1</moldb-inchi> <moldb-inchikey>JWSBLTYAQSJNFJ-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">298.2746044</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>4.3</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>CHEM311185</chemdb-id> <dsstox-id nil="true"/> <toxcast-id nil="true"/> <stoff-ident-origin nil="true"/> <stoff-ident-id nil="true"/> <susdat-id nil="true"/> <iupac>3-(1-methylpiperidin-1-ium-1-yl)propyl 2,2,4,4-tetramethylpentanoate</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>Lipids and lipid-like molecules</superklass> <klass>Fatty Acyls</klass> <subklass>Fatty acid esters</subklass> <paper-count type="integer" nil="true"/> <sync-id>CED0266162</sync-id> <structure-inchikey>JWSBLTYAQSJNFJ-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>200400000000000002008100000020000000100000000000000000000000000000000000000000000000000000000000008000200020000080000000000000000000000000000000000000000000020000200000000001000000010000002200000000000100000000000000000000000000000210000000000000000400000008000040c0000000000000000000000000000000000000000000000000000000000000000000000000000000000000000100000000000000000000000000000200000000000000010000000200000000000000000020000002004000000000000000000000000000000000000000010400000000000000000000000000000000</structure-fingerprint> <structure-pattern-fingerprint>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</structure-pattern-fingerprint> <structure-pickle type="binary" encoding="base64">776t3gAAAAAQAAAAAwAAAAAAAAAVAAAAFQAAAIABBgBgAAAAAQMGACAAAAAE BgBgAAAAAQMGAGAAAAABAwYAYAAAAAICBgAgAAAABAYAYAAAAAEDBgBgAAAA AQMGACgAAAADBAgAKAAAAAMCCAAoAAAAAwIGAGAAAAACAgYAYAAAAAICBgBg AAAAAgIHICIAAAABBAYAYAAAAAICBgBgAAAAAgIGAGAAAAACAgYAYAAAAAIC BgBgAAAAAgIGAGAAAAABAwsAAQABAgABAwABBAAEBQAFBgAFBwAFCAAICSgC CAogCgsACwwADA0ADQ4ADg8ADxAAEBEAERIAEhMADhQAEw4AQgEAAAAGDhMS ERAPFwQAAAAAAAAAFg== </structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T05:21:34Z</structure-indexed-at> </compound>