<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">282157</id>
  <title nil="true"/>
  <common-name>5-[ethoxy(propan-2-yloxy)phosphinothioyl]oxy-2-methyl-4-methylsulfanylpyridazin-3-one</common-name>
  <description>5-[ethoxy(propan-2-yloxy)phosphinothioyl]oxy-2-methyl-4-methylsulfanylpyridazin-3-one belongs to the thiophosphoric acid esters, a subclass of organic thiophosphoric acids and derivatives within the organic compounds. It has the formula C11H19N2O4PS2 and an average molecular weight of 338.40 g/mol.</description>
  <cas>59631-20-8</cas>
  <pubchem-id>3042365</pubchem-id>
  <chemical-formula>C11H19N2O4PS2</chemical-formula>
  <weight>338.4</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">2026-08-27T17:37:20Z</created-at>
  <updated-at type="dateTime">2026-08-27T17:37:20Z</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=C(C(=O)N(N=C1)C)SC)OC(C)C</moldb-smiles>
  <moldb-formula>C11H19N2O4PS2</moldb-formula>
  <moldb-inchi>InChI=1S/C11H19N2O4PS2/c1-6-15-18(19,16-8(2)3)17-9-7-12-13(4)11(14)10(9)20-5/h7-8H,6H2,1-5H3</moldb-inchi>
  <moldb-inchikey>VMCJLFRCFPCPTO-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">338.0523864</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>2.7</logp>
  <hmdb-id nil="true"/>
  <chembl-id nil="true"/>
  <chemspider-id nil="true"/>
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  <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>CHEM278050</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-methyl-4-methylsulfanylpyridazin-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>CED0234105</sync-id>
  <structure-inchikey>VMCJLFRCFPCPTO-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>40000080001000000000800040000800000000000000000080000000000000000010001002000020000000080000002000200000000000000000000000000080000010000000000000000400000000000020000000000100000000000000000000000000000000002000000000000100000000000100000000000000000000000000000040000000000040000000004000000000000018000000020000000000000000000000000000000000080000000000000000000010000000000000000100000000000000000000000000000000000000000100081040000000000000400000000000000820000040000000100000000000020020200000000000000000</structure-fingerprint>
  <structure-pattern-fingerprint>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</structure-pattern-fingerprint>
  <structure-pickle>ï¾­Þ������������������������€���`�������`������� ������ ������(�������(������@(������@(������@(�������(������@(������@(������@h��������`������� ������`������� ������`�������`�������`������������������������ ��h���h��	(��
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  <structure-indexed-at type="dateTime">2026-09-19T04:57:02Z</structure-indexed-at>
</compound>
