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<compound>
  <id type="integer">8797</id>
  <title nil="true"/>
  <common-name>P-TOLYL LAURATE</common-name>
  <description>P-TOLYL LAURATE belongs to the phenol esters, a class of benzenoids within the organic compounds. This compound has the formula C19H30O2 and an average molecular weight of 290.44 g/mol. In industrial applications, it is utilized as a flavouring and nutrient.</description>
  <cas>10024-57-4</cas>
  <pubchem-id>61434</pubchem-id>
  <chemical-formula>C19H30O2</chemical-formula>
  <weight>290.4</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">2016-05-19T02:29:10Z</created-at>
  <updated-at type="dateTime">2026-08-20T04:13:46Z</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>CCCCCCCCCCCC(=O)OC1=CC=C(C)C=C1</moldb-smiles>
  <moldb-formula>C19H30O2</moldb-formula>
  <moldb-inchi>InChI=1S/C19H30O2/c1-3-4-5-6-7-8-9-10-11-12-19(20)21-18-15-13-17(2)14-16-18/h13-16H,3-12H2,1-2H3</moldb-inchi>
  <moldb-inchikey>GRSHNQARIXQRDQ-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal">290.4403</moldb-average-mass>
  <moldb-mono-mass type="decimal">290.224580204</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>7.2</logp>
  <hmdb-id nil="true"/>
  <chembl-id nil="true"/>
  <chemspider-id>55358</chemspider-id>
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  <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>CHEM007692</chemdb-id>
  <dsstox-id>DTXSID60143048</dsstox-id>
  <toxcast-id nil="true"/>
  <stoff-ident-origin nil="true"/>
  <stoff-ident-id nil="true"/>
  <susdat-id>NS00021419</susdat-id>
  <iupac>(4-methylphenyl) dodecanoate</iupac>
  <moldb-polar-surface-area>26.3</moldb-polar-surface-area>
  <moldb-refractivity>88.26749999999998</moldb-refractivity>
  <moldb-polarizability>36.93373193064581</moldb-polarizability>
  <moldb-rotatable-bond-count>12</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>-7.180090576638072</moldb-pka-strongest-basic>
  <moldb-physiological-charge>0</moldb-physiological-charge>
  <moldb-number-of-rings>1</moldb-number-of-rings>
  <moldb-alogps-logp>7.02</moldb-alogps-logp>
  <moldb-alogps-logs>-6.57</moldb-alogps-logs>
  <moldb-alogps-solubility>7.82e-05 g/l</moldb-alogps-solubility>
  <kingdom>Organic compounds</kingdom>
  <superklass>Benzenoids</superklass>
  <klass>Phenol esters</klass>
  <subklass nil="true"/>
  <paper-count type="integer">0</paper-count>
  <sync-id>CED0044220</sync-id>
  <structure-inchikey>GRSHNQARIXQRDQ-UHFFFAOYSA-N</structure-inchikey>
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  <structure-indexed-at type="dateTime">2026-09-19T04:03:27Z</structure-indexed-at>
</compound>
