<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">346370</id>
  <title nil="true"/>
  <common-name>(4-ethoxyphenyl)methyl-triphenylphosphanium</common-name>
  <description>(4-ethoxyphenyl)methyl-triphenylphosphanium is a compound with the formula C27H26OP+. It has an average molecular weight of 397.50 g/mol.</description>
  <cas nil="true"/>
  <pubchem-id>2724471</pubchem-id>
  <chemical-formula>C27H26OP+</chemical-formula>
  <weight>397.5</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">2026-08-31T09:47:29Z</created-at>
  <updated-at type="dateTime">2026-08-31T09:47:29Z</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>CCOC1=CC=C(C=C1)C[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4</moldb-smiles>
  <moldb-formula>C27H26OP+</moldb-formula>
  <moldb-inchi>InChI=1S/C27H26OP/c1-2-28-24-20-18-23(19-21-24)22-29(25-12-6-3-7-13-25,26-14-8-4-9-15-26)27-16-10-5-11-17-27/h3-21H,2,22H2,1H3/q+1</moldb-inchi>
  <moldb-inchikey>QCMHSYZNHGLMAU-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">397.1721274</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>6.5</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>CHEM342263</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>(4-ethoxyphenyl)methyl-triphenylphosphanium</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>Phenylphosphines and derivatives</subklass>
  <paper-count type="integer" nil="true"/>
  <sync-id>CED0296723</sync-id>
  <structure-inchikey>QCMHSYZNHGLMAU-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>40000000000000000401800002000000000000000000000000000000000400000000000002000200200000000000000004000000000000000000000000000000000000000000000000000000000000000000000000000100000200000000000000000000000000000000000000000000000000000000000000000040000000000000000040040000800000000000000000000000000100000000020000000000000400000000000000001000080000000000000000080000000000000000000000000000000000000000000000000000000000000000000000000220000000000000000000020000000044000000000000000200000000000000000000000000</structure-fingerprint>
  <structure-pattern-fingerprint>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</structure-pattern-fingerprint>
  <structure-pickle type="binary" encoding="base64">776t3gAAAAAQAAAAAwAAAAAAAAAdAAAAIAAAAIABBgBgAAAAAQMGAGAAAAAC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</structure-pickle>
  <structure-indexed-at type="dateTime">2026-09-19T05:45:07Z</structure-indexed-at>
</compound>
