<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">85891</id>
  <title nil="true"/>
  <common-name>2-Cyclohexyl-2-methyl-1,3-dioxolane-4-methanol</common-name>
  <description>2-Cyclohexyl-2-methyl-1,3-dioxolane-4-methanol belongs to the ethers, a subclass of organooxygen compounds within the organic compounds. This organic oxygen compound has the chemical formula C11H20O3 and an average molecular weight of 200.28 g/mol.</description>
  <cas>5694-77-9</cas>
  <pubchem-id>21900</pubchem-id>
  <chemical-formula>C11H20O3</chemical-formula>
  <weight>200.27</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">2026-04-04T21:00:11Z</created-at>
  <updated-at type="dateTime">2026-08-18T13:11:11Z</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>CC1(OCC(CO)O1)C1CCCCC1</moldb-smiles>
  <moldb-formula>C11H20O3</moldb-formula>
  <moldb-inchi>InChI=1/C11H20O3/c1-11(9-5-3-2-4-6-9)13-8-10(7-12)14-11/h9-10,12H,2-8H2,1H3</moldb-inchi>
  <moldb-inchikey>MNGGBXINICRUAP-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal">200.278</moldb-average-mass>
  <moldb-mono-mass type="decimal">200.1412445</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>1.8</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>CHEM081784</chemdb-id>
  <dsstox-id>DTXSID30972387</dsstox-id>
  <toxcast-id nil="true"/>
  <stoff-ident-origin nil="true"/>
  <stoff-ident-id nil="true"/>
  <susdat-id>NS00046095</susdat-id>
  <iupac>(2-cyclohexyl-2-methyl-1,3-dioxolan-4-yl)methanol</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>Organic oxygen compounds</superklass>
  <klass>Organooxygen compounds</klass>
  <subklass>Ethers</subklass>
  <paper-count type="integer">0</paper-count>
  <sync-id>CED0133302</sync-id>
  <structure-inchikey>MNGGBXINICRUAP-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>20000000000000000080800000000000000000000000000000000002000000000000000000000000000001000000000000000000000000000020000000000000000080000000040000000000000000000000800000000000000000000000000000000000010000000000000001000020000000020000000000000000000000500800000048028000000000000000000000000000000000000000000000000020000000000004000000000000000100000000000000020000000000000008000100000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000010000000000000000000000000008000</structure-fingerprint>
  <structure-pattern-fingerprint>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</structure-pattern-fingerprint>
  <structure-pickle>ï¾­Þ������������������������€���`������� ������ ������`�������`�������`�������`������� ������`�������`�������`�������`�������`�������`�������������������������������	�	
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  <structure-indexed-at type="dateTime">2026-09-19T04:30:32Z</structure-indexed-at>
</compound>
