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<compound>
  <id type="integer">6791</id>
  <title nil="true"/>
  <common-name>ETHYL OLEATE</common-name>
  <description>Ethyl oleate is an organic compound with the formula C20H38O2 and an average molecular weight of 310.52 g/mol. ETHYL OLEATE belongs to the fatty acid esters, a subclass of fatty acyls within the organic compounds. In industrial applications, this substance is utilized as a softener and conditioner, a fragrance, and as a flavouring and nutrient.

The compound is present in polypropylene plastics. It has been recorded in six sources, including food contact materials and the preparation of vinegar, wine, or sparkling wine. It is also found in household cleaning and consumer products, specifically other smoking requisites, as well as in electrical and electronic equipment such as power cables and communication cables or conductors. Exposure to ethyl oleate may occur through inhalation, oral ingestion, or touch.</description>
  <cas>111-62-6</cas>
  <pubchem-id>5363269</pubchem-id>
  <chemical-formula>C20H38O2</chemical-formula>
  <weight>310.5</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">2016-05-19T02:05:14Z</created-at>
  <updated-at type="dateTime">2026-08-20T06:58:57Z</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>[H]\C(CCCCCCCC)=C(/[H])CCCCCCCC(=O)OCC</moldb-smiles>
  <moldb-formula>C20H38O2</moldb-formula>
  <moldb-inchi>InChI=1S/C20H38O2/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22-4-2/h11-12H,3-10,13-19H2,1-2H3/b12-11-</moldb-inchi>
  <moldb-inchikey>LVGKNOAMLMIIKO-QXMHVHEDSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal">310.522</moldb-average-mass>
  <moldb-mono-mass type="decimal">310.287180464</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>8</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>CHEM005686</chemdb-id>
  <dsstox-id>DTXSID3047633</dsstox-id>
  <toxcast-id>47633</toxcast-id>
  <stoff-ident-origin nil="true"/>
  <stoff-ident-id nil="true"/>
  <susdat-id>NS00079024</susdat-id>
  <iupac>ethyl (Z)-octadec-9-enoate</iupac>
  <moldb-polar-surface-area>26.3</moldb-polar-surface-area>
  <moldb-refractivity>96.91989999999998</moldb-refractivity>
  <moldb-polarizability>41.162613000794906</moldb-polarizability>
  <moldb-rotatable-bond-count>17</moldb-rotatable-bond-count>
  <moldb-acceptor-count>1</moldb-acceptor-count>
  <moldb-donor-count>0</moldb-donor-count>
  <moldb-pka-strongest-acidic nil="true"/>
  <moldb-pka-strongest-basic>-7.032123337017807</moldb-pka-strongest-basic>
  <moldb-physiological-charge>0</moldb-physiological-charge>
  <moldb-number-of-rings>0</moldb-number-of-rings>
  <moldb-alogps-logp>8.16</moldb-alogps-logp>
  <moldb-alogps-logs>-7.16</moldb-alogps-logs>
  <moldb-alogps-solubility>2.17e-05 g/l</moldb-alogps-solubility>
  <kingdom>Organic compounds</kingdom>
  <superklass>Lipids and lipid-like molecules</superklass>
  <klass>Fatty Acyls</klass>
  <subklass>Fatty acid esters</subklass>
  <paper-count type="integer">515</paper-count>
  <sync-id>CED0006964</sync-id>
  <structure-inchikey>LVGKNOAMLMIIKO-QXMHVHEDSA-N</structure-inchikey>
  <structure-fingerprint>800000000000000010000000000000000000000000000000000002000000000000000000000000004000000000000000000000000000000000000000000000010000000000000020000004000300000000000000000001000020010000000000000000000000000000000000000000000000000000000000000040000000000000000000010000000000000000000000020000001000000000000000000000080000002001000000000088000000000000000000000000000008000000000000000000000000000000000000002000000010000000000000000000000000000000000000010400000000000000000000000000004000</structure-fingerprint>
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  <structure-indexed-at type="dateTime">2026-09-19T04:02:32Z</structure-indexed-at>
</compound>
