80265 <common-name>Hexanedioic acid, ester with 1,4-butanediol</common-name> <description>Hexanedioic acid, ester with 1,4-butanediol is an organic compound with the formula C10H18O5 and an average molecular weight of 218.25 g/mol. Hexanedioic acid, ester with 1,4-butanediol belongs to the fatty acids and conjugates, a subclass of fatty acyls within the organic compounds. It is further classified under the superclass of lipids and lipid-like molecules. This compound is found in or released from one recorded source: electrical and electronic equipment, specifically discharge lamps.</description> <cas>86923-79-7</cas> <pubchem-id>208866</pubchem-id> <chemical-formula>C10H18O5</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">2026-04-04T15:34:47Z</created-at> <updated-at type="dateTime">2026-04-04T15:34:47Z</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>OCCCCOC(=O)CCCCC(O)=O</moldb-smiles> <moldb-formula>C10H18O5</moldb-formula> <moldb-inchi>InChI=1S/C10H18O5/c11-7-3-4-8-15-10(14)6-2-1-5-9(12)13/h11H,1-8H2,(H,12,13)</moldb-inchi> <moldb-inchikey>ZSYUYBMMNNGZIB-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal">218.249</moldb-average-mass> <moldb-mono-mass type="decimal">218.115424</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp nil="true"/> <hmdb-id nil="true"/> <chembl-id nil="true"/> <chemspider-id>180971</chemspider-id> <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>CHEM076158</chemdb-id> <dsstox-id>DTXSID60235972</dsstox-id> <toxcast-id nil="true"/> <stoff-ident-origin nil="true"/> <stoff-ident-id nil="true"/> <susdat-id>NS00039158</susdat-id> <iupac>6-(4-hydroxybutoxy)-6-oxohexanoic acid</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 acids and conjugates</subklass> <paper-count type="integer">411</paper-count> <sync-id>CED0011940</sync-id> <structure-inchikey>ZSYUYBMMNNGZIB-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>40000000000000000800000000000000010000000000000000002000000000000000000000000000000000000000004000000000000000000004000000000000000040000000000000000000000000020000004000100000000000000000000000000010000000000000000000000000000000000000000000000000000000020000000000000000002000020000000000000000000000000000040001000010000000000000000000000002001000000000000000000000000000000000000000008000000000000000000000000000000000000000002400000000000000000000000000000000000000000010400000000000000000000000000000000</structure-fingerprint> <structure-pattern-fingerprint>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</structure-pattern-fingerprint> <structure-pickle type="binary" encoding="base64">776t3gAAAAAQAAAAAwAAAAAAAAAPAAAADgAAAIABCABgAAAAAQEGAGAAAAAC AgYAYAAAAAICBgBgAAAAAgIGAGAAAAACAggAKAAAAAMCBgAoAAAAAwQIACgA AAADAgYAYAAAAAICBgBgAAAAAgIGAGAAAAACAgYAYAAAAAICBgAoAAAAAwQI AGgAAAADAQEIACgAAAADAgsAAQABAgACAwADBAAEBQAFBiAGBygCBggACAkA CQoACgsACwwADA0gDA4oAkIAAAAAFwQAAAAAAAAAFg== </structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T04:27:13Z</structure-indexed-at> </compound>