<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">278931</id>
  <title nil="true"/>
  <common-name>5-[ethoxy(propan-2-yloxy)phosphinothioyl]oxy-2-methylpyridazin-3-one</common-name>
  <description>5-[ethoxy(propan-2-yloxy)phosphinothioyl]oxy-2-methylpyridazin-3-one belongs to the thiophosphoric acid esters, a subclass of organic thiophosphoric acids and derivatives within the organic compounds. It has the chemical formula C10H17N2O4PS and an average molecular weight of 292.29 g/mol.</description>
  <cas>72039-16-8</cas>
  <pubchem-id>3055117</pubchem-id>
  <chemical-formula>C10H17N2O4PS</chemical-formula>
  <weight>292.29</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">2026-08-26T18:50:56Z</created-at>
  <updated-at type="dateTime">2026-08-26T18:50:56Z</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(=S)(OC1=CC(=O)N(N=C1)C)OC(C)C</moldb-smiles>
  <moldb-formula>C10H17N2O4PS</moldb-formula>
  <moldb-inchi>InChI=1S/C10H17N2O4PS/c1-5-14-17(18,15-8(2)3)16-9-6-10(13)12(4)11-7-9/h6-8H,5H2,1-4H3</moldb-inchi>
  <moldb-inchikey>AWHQQQNMQNXHBP-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">292.0646652</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>2</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>CHEM274824</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>5-[ethoxy(propan-2-yloxy)phosphinothioyl]oxy-2-methylpyridazin-3-one</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 thiophosphoric acids and derivatives</klass>
  <subklass>Thiophosphoric acid esters</subklass>
  <paper-count type="integer" nil="true"/>
  <sync-id>CED0231005</sync-id>
  <structure-inchikey>AWHQQQNMQNXHBP-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>40000080401000000000800040000000000000000000000080000000000000000010001002040020200000000000002000000000000000000000000000000000000000000000000000000400000000000020000000000100000000000000000000000000000000000000000000100000000000000100000000000000000000000000000050000000000040000000044000000000000018000000020000000000000000000000000000000000080400000000000000000000000000000000000100000000000000000000000000000000000000000100080040000000000400400000000000010800000040000000000000000000020000200000000000000000</structure-fingerprint>
  <structure-pattern-fingerprint>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</structure-pattern-fingerprint>
  <structure-pickle>ï¾­Þ������������������������€���`�������`������� ������ ������(�������(������@(������@h�������@(�������(������@(������@(������@h��������`������� ������`�������`�������`������������������������ ��h���h��	(��
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  <structure-indexed-at type="dateTime">2026-09-19T04:54:22Z</structure-indexed-at>
</compound>
