<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">97720</id>
  <title nil="true"/>
  <common-name>(Isopropylidene)bis(4,1-phenyleneoxyethylene) dilaurate</common-name>
  <description>(Isopropylidene)bis(4,1-phenyleneoxyethylene) dilaurate belongs to the diphenylmethanes, a subclass of benzene and substituted derivatives within the organic compounds. It is classified as a benzenoid with the chemical formula C43H68O6. With an average molecular weight of 681.01 g/mol, (Isopropylidene)bis(4,1-phenyleneoxyethylene) dilaurate is a heavy molecule.</description>
  <cas>32154-05-5</cas>
  <pubchem-id>122561</pubchem-id>
  <chemical-formula>C43H68O6</chemical-formula>
  <weight>681.0</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">2026-04-05T05:27:15Z</created-at>
  <updated-at type="dateTime">2026-08-22T14:35:19Z</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)OCCOC1=CC=C(C=C1)C(C)(C)C1=CC=C(OCCOC(=O)CCCCCCCCCCC)C=C1</moldb-smiles>
  <moldb-formula>C43H68O6</moldb-formula>
  <moldb-inchi>InChI=1/C43H68O6/c1-5-7-9-11-13-15-17-19-21-23-41(44)48-35-33-46-39-29-25-37(26-30-39)43(3,4)38-27-31-40(32-28-38)47-34-36-49-42(45)24-22-20-18-16-14-12-10-8-6-2/h25-32H,5-24,33-36H2,1-4H3</moldb-inchi>
  <moldb-inchikey>DPZRLVKUOYEOLE-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal">681.011</moldb-average-mass>
  <moldb-mono-mass type="decimal">680.5015899</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>14.8</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>CHEM093613</chemdb-id>
  <dsstox-id>DTXSID3067659</dsstox-id>
  <toxcast-id nil="true"/>
  <stoff-ident-origin nil="true"/>
  <stoff-ident-id nil="true"/>
  <susdat-id>NS00060109</susdat-id>
  <iupac>2-[4-[2-[4-(2-dodecanoyloxyethoxy)phenyl]propan-2-yl]phenoxy]ethyl dodecanoate</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">0</paper-count>
  <sync-id>CED0158693</sync-id>
  <structure-inchikey>DPZRLVKUOYEOLE-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>84000000000000000080000200200000001000000000000000000000000000000000000200000020000000000000000080000000000000000000000000000000000000000000000001000000000000002000000d000100000200000000000000000020010000000000000000000000000000000000000000000000000000000020000040000800000000000000010000000000000000000000001000001000000000000000000000000000082001000040000008080000000000000000000000000008000000000000000000000000400000000000000000000200000000000000000000000000000040000000010400000000000000000000000000000000</structure-fingerprint>
  <structure-pattern-fingerprint>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</structure-pattern-fingerprint>
  <structure-pickle>ï¾­Þ����������������1���2���€���`�������`�������`�������`�������`�������`�������`�������`�������`�������`�������`�������(�������(�������(�������`�������`�������(������@(������@h�������@h�������@(������@h�������@h�������� ������`�������`������@(������@h�������@h�������@(�������(�������`�������`�������(�������(�������(�������`�������`�������`�������`�������`�������`�������`�������`�������`�������`�������`������@h�������@h��������������������������������	�	
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  <structure-indexed-at type="dateTime">2026-09-19T04:37:43Z</structure-indexed-at>
</compound>
