<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">294577</id>
  <title nil="true"/>
  <common-name>6-[ethyl(pentoxy)phosphoryl]oxyhexyl-hydroxy-methyl-sulfanylidene-lambda5-phosphane</common-name>
  <description>6-[ethyl(pentoxy)phosphoryl]oxyhexyl-hydroxy-methyl-sulfanylidene-lambda5-phosphane belongs to the phosphonic acid diesters, a subclass of organic phosphonic acids and derivatives within the organic compounds. This organic acid and derivative has the formula C14H32O4P2S and an average molecular weight of 358.42 g/mol.</description>
  <cas>109438-26-8</cas>
  <pubchem-id>3066032</pubchem-id>
  <chemical-formula>C14H32O4P2S</chemical-formula>
  <weight>358.42</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">2026-08-28T10:16:53Z</created-at>
  <updated-at type="dateTime">2026-08-28T10:16:53Z</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>CCCCCOP(=O)(CC)OCCCCCCP(=S)(C)O</moldb-smiles>
  <moldb-formula>C14H32O4P2S</moldb-formula>
  <moldb-inchi>InChI=1S/C14H32O4P2S/c1-4-6-9-12-17-20(16,5-2)18-13-10-7-8-11-14-19(3,15)21/h4-14H2,1-3H3,(H,15,21)</moldb-inchi>
  <moldb-inchikey>DNVLDPOHTBGMFU-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">358.1496547</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>3.4</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>CHEM290470</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>6-[ethyl(pentoxy)phosphoryl]oxyhexyl-hydroxy-methyl-sulfanylidene-lambda5-phosphane</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 acids and derivatives</superklass>
  <klass>Organic phosphonic acids and derivatives</klass>
  <subklass>Phosphonic acid diesters</subklass>
  <paper-count type="integer" nil="true"/>
  <sync-id>CED0246053</sync-id>
  <structure-inchikey>DNVLDPOHTBGMFU-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>40000000000000000800040000000000000000000000082000000000000000000000002000000000002000000000000000000000000000000000002000000000000000000000000010000000000000020080020000100000000000000000000000020010000000000000000000000000000000000000000000000000200000000000040000000000000000000010000000000000000000000000040000000000000000000000000800000000000000000000008000000000008000000000000400000000000000010000000000000000000000000080040000000000000000000000000020000000004000000010000000008000000000010000000000000</structure-fingerprint>
  <structure-pattern-fingerprint>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</structure-pattern-fingerprint>
  <structure-pickle>ï¾­Þ������������������������€���`�������`�������`�������`�������`������� ������ ������(�������`�������`������� ������`�������`�������`�������`�������`�������`������� ������(�������`�������`��������������������������������	��
�
����������������������������B��������������</structure-pickle>
  <structure-indexed-at type="dateTime">2026-09-19T05:06:08Z</structure-indexed-at>
</compound>
