<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">290551</id>
  <title nil="true"/>
  <common-name>2-[2-(2,6-dichloro-n-hydroxyanilino)-5-hydroxyphenyl]acetic acid</common-name>
  <description nil="true"/>
  <cas nil="true"/>
  <pubchem-id>10065052</pubchem-id>
  <chemical-formula>C14H11Cl2NO4</chemical-formula>
  <weight>328.1</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">2026-08-28T04:17:05Z</created-at>
  <updated-at type="dateTime">2026-08-28T04:17:05Z</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>C1=CC(=C(C(=C1)Cl)N(C2=C(C=C(C=C2)O)CC(=O)O)O)Cl</moldb-smiles>
  <moldb-formula>C14H11Cl2NO4</moldb-formula>
  <moldb-inchi>InChI=1S/C14H11Cl2NO4/c15-10-2-1-3-11(16)14(10)17(21)12-5-4-9(18)6-8(12)7-13(19)20/h1-6,18,21H,7H2,(H,19,20)</moldb-inchi>
  <moldb-inchikey>KPXTUWFWKOJDLM-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">327.0065132</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>3.5</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>CHEM286444</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-[2-(2,6-dichloro-n-hydroxyanilino)-5-hydroxyphenyl]acetic acid</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>N-phenylhydroxylamines</klass>
  <subklass>N-aryl-N-phenylhydroxylamines</subklass>
  <paper-count type="integer" nil="true"/>
  <sync-id>CED0242164</sync-id>
  <structure-inchikey>KPXTUWFWKOJDLM-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>200000000800000000000000001000000000000080000000000000000000000000000040000000002000404000100000000000000000000000000000000000000400000000200000000004020000000000000000000000040000000000000010000000400000000104000000020000000000000020000000000000001000000000000800000000000100000000000000000000000000000000000000000004000000004000000080000000010000000000000000000000000000000000000000000002000000000000000002010000000000000400200000000000000000000000000000040000000000400000000000000000000000020004000</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��h��� 	�������(��� ��������h��h�B������������	
�������������</structure-pickle>
  <structure-indexed-at type="dateTime">2026-09-19T05:03:09Z</structure-indexed-at>
</compound>
