<?xml version="1.0" encoding="UTF-8"?>
<compound>
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  <common-name>2-[4-(diethoxyphosphorylmethyl)-n-(2-hydroxyethyl)anilino]ethanol</common-name>
  <description nil="true"/>
  <cas nil="true"/>
  <pubchem-id>231349</pubchem-id>
  <chemical-formula>C15H26NO5P</chemical-formula>
  <weight>331.34</weight>
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  <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">2026-08-28T15:23:50Z</created-at>
  <updated-at type="dateTime">2026-08-28T15:23:50Z</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>CCOP(=O)(CC1=CC=C(C=C1)N(CCO)CCO)OCC</moldb-smiles>
  <moldb-formula>C15H26NO5P</moldb-formula>
  <moldb-inchi>InChI=1S/C15H26NO5P/c1-3-20-22(19,21-4-2)13-14-5-7-15(8-6-14)16(9-11-17)10-12-18/h5-8,17-18H,3-4,9-13H2,1-2H3</moldb-inchi>
  <moldb-inchikey>QRJPJVKJJQOLOK-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">331.1548599</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>0.5</logp>
  <hmdb-id nil="true"/>
  <chembl-id nil="true"/>
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  <structure-image-content-type nil="true"/>
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  <structure-image-updated-at type="dateTime" nil="true"/>
  <biodb-id nil="true"/>
  <synthesis-reference nil="true"/>
  <structure-image-caption nil="true"/>
  <chemdb-id>CHEM294891</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>2-[4-(diethoxyphosphorylmethyl)-n-(2-hydroxyethyl)anilino]ethanol</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 nitrogen compounds</superklass>
  <klass>Organonitrogen compounds</klass>
  <subklass>Amines</subklass>
  <paper-count type="integer" nil="true"/>
  <sync-id>CED0250317</sync-id>
  <structure-inchikey>QRJPJVKJJQOLOK-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>8000000000000800000000000000000000000000080000002000000000000000002000204000000000000000000000000000000000000004002002000000000000000000000000020000000000020000000000100000000000000000000000000010000000000000000004000000000000000000080000000000000004000000050000400008000000000000000002000000010000000020000000000000000000000000000000000080000000000000000010000000000000000000000400000000000000000000000000000000001000000080000000220000000000000000000000000000040000000000000000001000000000000000000000000</structure-fingerprint>
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  <structure-pickle>ï¾­Þ������������������������€���`�������`������� ������ ������(�������`������@(������@h�������@h�������@(������@h�������@h��������(�������`�������`�������`�������`�������`�������`������� ������`�������`���������������������������h���h��	h�	
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	������������</structure-pickle>
  <structure-indexed-at type="dateTime">2026-09-19T05:09:27Z</structure-indexed-at>
</compound>
