<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">365320</id>
  <title nil="true"/>
  <common-name>2-(diethoxyphosphorylsulfanylmethyl)pyridazin-3-one</common-name>
  <description>2-(diethoxyphosphorylsulfanylmethyl)pyridazin-3-one is a chemical compound with the formula C9H15N2O4PS. It has an average molecular weight of 278.27 g/mol.</description>
  <cas>51376-77-3</cas>
  <pubchem-id>3039934</pubchem-id>
  <chemical-formula>C9H15N2O4PS</chemical-formula>
  <weight>278.27</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">2026-09-01T15:51:13Z</created-at>
  <updated-at type="dateTime">2026-09-01T15:51:13Z</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)(OCC)SCN1C(=O)C=CC=N1</moldb-smiles>
  <moldb-formula>C9H15N2O4PS</moldb-formula>
  <moldb-inchi>InChI=1S/C9H15N2O4PS/c1-3-14-16(13,15-4-2)17-8-11-9(12)6-5-7-10-11/h5-7H,3-4,8H2,1-2H3</moldb-inchi>
  <moldb-inchikey>QMWADXAINROGIU-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">278.0490151</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>0</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>CHEM361213</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-(diethoxyphosphorylsulfanylmethyl)pyridazin-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>CED0315276</sync-id>
  <structure-inchikey>QMWADXAINROGIU-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>1000000004800000000800000000020000000080000000000000000000000002800020000000000002002000000000000000000000000002000000000000000000000000000000000000000020000000000100000400000000000000000000010000000080040000000000000000000100000000000000000200000000100040008000800000000000040000000000020010000000020000000000000000000000000000000000080000000000000000000000000000000000024000000000000000000000000000000000000000000000080000000200000000000000000000000000002040000000000000000000000000000000000000000000</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">2026-09-19T06:01:25Z</structure-indexed-at>
</compound>
