<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">282160</id>
  <title nil="true"/>
  <common-name>5-[ethoxy(propan-2-ylsulfanyl)phosphoryl]oxy-4-methoxy-2-methylpyridazin-3-one</common-name>
  <description>5-[ethoxy(propan-2-ylsulfanyl)phosphoryl]oxy-4-methoxy-2-methylpyridazin-3-one belongs to the pyridazines and derivatives, a subclass of diazines within the organic compounds. This organoheterocyclic compound has the chemical formula C11H19N2O5PS and an average molecular weight of 322.32 g/mol.</description>
  <cas>59693-39-9</cas>
  <pubchem-id>3042422</pubchem-id>
  <chemical-formula>C11H19N2O5PS</chemical-formula>
  <weight>322.32</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">2026-08-27T17:37:29Z</created-at>
  <updated-at type="dateTime">2026-08-27T17:37:29Z</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)(OC1=C(C(=O)N(N=C1)C)OC)SC(C)C</moldb-smiles>
  <moldb-formula>C11H19N2O5PS</moldb-formula>
  <moldb-inchi>InChI=1S/C11H19N2O5PS/c1-6-17-19(15,20-8(2)3)18-9-7-12-13(4)11(14)10(9)16-5/h7-8H,6H2,1-5H3</moldb-inchi>
  <moldb-inchikey>GZWLFHNYQHRICD-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">322.0752299</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>0.8</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>CHEM278053</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-ylsulfanyl)phosphoryl]oxy-4-methoxy-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>Organoheterocyclic compounds</superklass>
  <klass>Diazines</klass>
  <subklass>Pyridazines and derivatives</subklass>
  <paper-count type="integer" nil="true"/>
  <sync-id>CED0234108</sync-id>
  <structure-inchikey>GZWLFHNYQHRICD-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>400000800010000000008000000008000000000000000000800000000000000000100010020000200004000000000020000000000000000006000000020000800000110000000000000000000000000001202000000001000000080000000000000000000000000000c0000000000000000000000100000000000000000000000000000040008000000040000000004000000000002010000000020000000000000000000008000000000000080000000000000000000000000000000000000180000000000000010000000000000400000000000000080000000000000000000000000000000020000040000000000000000000000020000000000000000000</structure-fingerprint>
  <structure-pattern-fingerprint>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</structure-pattern-fingerprint>
  <structure-pickle>ï¾­Þ������������������������€���`�������`������� ������ ������(�������(������@(������@(������@(�������(������@(������@(������@h��������`�������(�������`������� ������`�������`�������`������������������������ ��h���h��	(��
h�
�h���h�
��� �����������������h�B��������
������������</structure-pickle>
  <structure-indexed-at type="dateTime">2026-09-19T04:57:02Z</structure-indexed-at>
</compound>
