<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">360920</id>
  <title nil="true"/>
  <common-name>(7-hydroxy-6-nitro-1-oxo-3,7-dihydro-2,1,3-benzoxadiazol-1-ium-4-ylidene)-dioxidoazanium</common-name>
  <description>(7-hydroxy-6-nitro-1-oxo-3,7-dihydro-2,1,3-benzoxadiazol-1-ium-4-ylidene)-dioxidoazanium is a chemical compound with the formula C6H4N4O7 and an average molecular weight of 244.12 g/mol. This substance has been found in or released from one recorded source: electrical and electronic equipment, specifically electric switches.</description>
  <cas nil="true"/>
  <pubchem-id>39368</pubchem-id>
  <chemical-formula>C6H4N4O7</chemical-formula>
  <weight>244.12</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">2026-09-01T09:33:49Z</created-at>
  <updated-at type="dateTime">2026-09-01T09:33:49Z</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=C(C(C2=C(C1=[N+]([O-])[O-])NO[N+]2=O)O)[N+](=O)[O-]</moldb-smiles>
  <moldb-formula>C6H4N4O7</moldb-formula>
  <moldb-inchi>InChI=1S/C6H4N4O7/c11-6-3(9(14)15)1-2(8(12)13)4-5(6)10(16)17-7-4/h1,6-7,11H</moldb-inchi>
  <moldb-inchikey>WXYVKVUGTYSSMH-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">244.0079985</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>-0.5</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>CHEM356813</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>(7-hydroxy-6-nitro-1-oxo-3,7-dihydro-2,1,3-benzoxadiazol-1-ium-4-ylidene)-dioxidoazanium</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>Organoheterocyclic compounds</superklass>
  <klass>Benzoxadiazoles</klass>
  <subklass nil="true"/>
  <paper-count type="integer" nil="true"/>
  <sync-id>CED0311068</sync-id>
  <structure-inchikey>WXYVKVUGTYSSMH-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>80008000000400000100000000000000001000000000400000000000020000000000000000010000000000000000001000000040000000000000000000000000000000000000020800000000000001000000000400000200400010000000200000000000000000000000000000000000000000000100000000000000000000000200000000000000000001000000000040000400000000000006000000000000000080000000000048080000000000000000000000000000000000000000000000000100000000000000000000000000000000000000000000000000000000040000008000000040400001000000000000000200000</structure-fingerprint>
  <structure-pattern-fingerprint>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</structure-pattern-fingerprint>
  <structure-pickle type="binary" encoding="base64">776t3gAAAAAQAAAAAwAAAAAAAAARAAAAEgAAAIABBgBoAAAAAwMBBgAoAAAA
AwQGAGAAAAADAQZAKAAAAAMEBkAoAAAAAwQGACgAAAADBAcgKgAAAAEDBAgg
KgAAAP8DAQggKgAAAP8DAQdAOAAAAAMBAwhAKAAAAAMCB2AqAAAAAQMECAAo
AAAAAwIIAGAAAAABAQcgKgAAAAEDBAgAKAAAAAMCCCAqAAAA/wMBCwABKAIB
AgACAwADBGgMBAUgBQYoAgYHIAYIIAQJaAwJCmgMCgtoDAsMKAICDQABDiAO
DygCDhAgBQAgCwNoDEICAAAABgAFBAMCAQUJBAMLChcEAAAAAAAAABY=
</structure-pickle>
  <structure-indexed-at type="dateTime">2026-09-19T05:58:19Z</structure-indexed-at>
</compound>
