<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">317438</id>
  <title nil="true"/>
  <common-name>1-prop-2-enoxy-2-[(2-prop-2-enoxyphenyl)methyl]benzene</common-name>
  <description>1-prop-2-enoxy-2-[(2-prop-2-enoxyphenyl)methyl]benzene is a chemical compound with the formula C19H20O2. It has an average molecular weight of 280.40 g/mol.</description>
  <cas>71355-88-9</cas>
  <pubchem-id>3054548</pubchem-id>
  <chemical-formula>C19H20O2</chemical-formula>
  <weight>280.4</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">2026-08-29T15:33:54Z</created-at>
  <updated-at type="dateTime">2026-08-29T15:33:54Z</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>C=CCOC1=CC=CC=C1CC2=CC=CC=C2OCC=C</moldb-smiles>
  <moldb-formula>C19H20O2</moldb-formula>
  <moldb-inchi>InChI=1S/C19H20O2/c1-3-13-20-18-11-7-5-9-16(18)15-17-10-6-8-12-19(17)21-14-4-2/h3-12H,1-2,13-15H2</moldb-inchi>
  <moldb-inchikey>ATBANLMXJMAXRO-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">280.1463299</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>5.1</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>CHEM313331</chemdb-id>
  <dsstox-id nil="true"/>
  <toxcast-id nil="true"/>
  <stoff-ident-origin nil="true"/>
  <stoff-ident-id nil="true"/>
  <susdat-id nil="true"/>
  <iupac>1-prop-2-enoxy-2-[(2-prop-2-enoxyphenyl)methyl]benzene</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>Benzenoids</superklass>
  <klass>Benzene and substituted derivatives</klass>
  <subklass>Diphenylmethanes</subklass>
  <paper-count type="integer" nil="true"/>
  <sync-id>CED0268260</sync-id>
  <structure-inchikey>ATBANLMXJMAXRO-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>800000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000300000000000000000000020000000000000000000000000000000000001008000000000000000000000000000000000000800000000000000000008000000100000000000000000000000000000000000004000200080000002000020000082000000000000000000010000000000000040000000000040000000000000000000000000200000000000000000000000000000040000020000000000000100020000000000000000000</structure-fingerprint>
  <structure-pattern-fingerprint>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</structure-pattern-fingerprint>
  <structure-pickle>ï¾­Þ������������������������€���h��������h��������`�������(������@(������@h�������@h�������@h�������@h�������@(�������`������@(������@h�������@h�������@h�������@h�������@(�������(�������`�������h��������h������������������� ��h���h���h���h��	h�	
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����h��h��h���h���h��� ����������	�h���h�B������	��������������������</structure-pickle>
  <structure-indexed-at type="dateTime">2026-09-19T05:23:16Z</structure-indexed-at>
</compound>
