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<compound>
  <id type="integer">7506</id>
  <title nil="true"/>
  <common-name>8-P-MENTHENE-1,2-DIOL</common-name>
  <description>8-P-MENTHENE-1,2-DIOL belongs to the monoterpenoids, a subclass of prenol lipids within the organic compounds. This compound has the formula C10H18O2 and an average molecular weight of 170.25 g/mol. It is utilized industrially as a nutrient and a flavouring agent. 8-P-MENTHENE-1,2-DIOL is found in food contact materials, including food, food processing, and cookware. Recorded exposure routes for this substance include oral, inhalation, and touch.</description>
  <cas>1946-00-5</cas>
  <pubchem-id>94217</pubchem-id>
  <chemical-formula>C10H18O2</chemical-formula>
  <weight>170.25</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">2016-05-19T02:13:16Z</created-at>
  <updated-at type="dateTime">2026-04-17T15:58:01Z</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)C1CCC(C)(O)C(O)C1</moldb-smiles>
  <moldb-formula>C10H18O2</moldb-formula>
  <moldb-inchi>InChI=1S/C10H18O2/c1-7(2)8-4-5-10(3,12)9(11)6-8/h8-9,11-12H,1,4-6H2,2-3H3</moldb-inchi>
  <moldb-inchikey>WKZWTZTZWGWEGE-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal">170.2487</moldb-average-mass>
  <moldb-mono-mass type="decimal">170.13067982</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp nil="true"/>
  <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>CHEM006401</chemdb-id>
  <dsstox-id>DTXSID90862795</dsstox-id>
  <toxcast-id nil="true"/>
  <stoff-ident-origin nil="true"/>
  <stoff-ident-id nil="true"/>
  <susdat-id>NS00045313</susdat-id>
  <iupac nil="true"/>
  <moldb-polar-surface-area>40.46</moldb-polar-surface-area>
  <moldb-refractivity>48.7509</moldb-refractivity>
  <moldb-polarizability>19.661475084010412</moldb-polarizability>
  <moldb-rotatable-bond-count>1</moldb-rotatable-bond-count>
  <moldb-acceptor-count>2</moldb-acceptor-count>
  <moldb-donor-count>2</moldb-donor-count>
  <moldb-pka-strongest-acidic>13.72647686245353</moldb-pka-strongest-acidic>
  <moldb-pka-strongest-basic>-3.207704561297077</moldb-pka-strongest-basic>
  <moldb-physiological-charge>0</moldb-physiological-charge>
  <moldb-number-of-rings>1</moldb-number-of-rings>
  <moldb-alogps-logp>1.11</moldb-alogps-logp>
  <moldb-alogps-logs>-1.07</moldb-alogps-logs>
  <moldb-alogps-solubility>1.46e+01 g/l</moldb-alogps-solubility>
  <kingdom>Organic compounds</kingdom>
  <superklass>Lipids and lipid-like molecules</superklass>
  <klass>Prenol lipids</klass>
  <subklass>Monoterpenoids</subklass>
  <paper-count type="integer">0</paper-count>
  <sync-id>CED0044113</sync-id>
  <structure-inchikey>WKZWTZTZWGWEGE-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>4000000000000000000000000000000000000000000000000000000000000080000000000000020000000000000000000000000000000000000000040000000000001000000000000000000000000000000000008000000000010000000000000000000000000000020000000000020000010000520000000048000000000000000000000020200000000000000000000000400020000801000004000000000200000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000001000000000000000000000000008</structure-fingerprint>
  <structure-pattern-fingerprint>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</structure-pattern-fingerprint>
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</structure-pickle>
  <structure-indexed-at type="dateTime">2026-09-19T04:02:54Z</structure-indexed-at>
</compound>
