<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">363793</id>
  <title nil="true"/>
  <common-name>2-bis(methylsulfanyl)phosphorylsulfanyl-n,n-diethylethanamine</common-name>
  <description>2-bis(methylsulfanyl)phosphorylsulfanyl-n,n-diethylethanamine is a chemical compound with the formula C8H20NOPS3. It has an average molecular weight of 273.40 g/mol.</description>
  <cas nil="true"/>
  <pubchem-id>199735</pubchem-id>
  <chemical-formula>C8H20NOPS3</chemical-formula>
  <weight>273.4</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">2026-09-01T13:27:44Z</created-at>
  <updated-at type="dateTime">2026-09-01T13:27:44Z</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>CCN(CC)CCSP(=O)(SC)SC</moldb-smiles>
  <moldb-formula>C8H20NOPS3</moldb-formula>
  <moldb-inchi>InChI=1S/C8H20NOPS3/c1-5-9(6-2)7-8-14-11(10,12-3)13-4/h5-8H2,1-4H3</moldb-inchi>
  <moldb-inchikey>SRGBSOJAEDWAIC-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">273.0444648</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>1.5</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>CHEM359686</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-bis(methylsulfanyl)phosphorylsulfanyl-n,n-diethylethanamine</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 nitrogen compounds</superklass>
  <klass>Organonitrogen compounds</klass>
  <subklass>Amines</subklass>
  <paper-count type="integer" nil="true"/>
  <sync-id>CED0313816</sync-id>
  <structure-inchikey>SRGBSOJAEDWAIC-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>800000000800000000000000000080000004000000100000000002000000000000020000000000204000000000000000080002000000000000000000000000000000000800000020000000000000000000000000000000000000000000000000040000004000000000000800000000000000000000000000000040000000000000000000000000000002000000000000000000000000000000000000000000000000000000000000000000000040000000000000000000000000000000000000000000000000000000000000000000000000000800000000000000000000000000000000200000000001000000040000000000000000</structure-fingerprint>
  <structure-pattern-fingerprint>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</structure-pattern-fingerprint>
  <structure-pickle type="binary" encoding="base64">776t3gAAAAAQAAAAAwAAAAAAAAAOAAAADQAAAIABBgBgAAAAAQMGAGAAAAAC
AgcAIAAAAAMGAGAAAAACAgYAYAAAAAEDBgBgAAAAAgIGAGAAAAACAhAAIAAA
AAIPACAAAAAFCAAoAAAAAwIQACAAAAACBgBgAAAAAQMQACAAAAACBgBgAAAA
AQMLAAEAAQIAAgMAAwQAAgUABQYABgcABwgACAkIAggKAAoLAAgMAAwNAEIA
AAAAFwQAAAAAAAAAFg==
</structure-pickle>
  <structure-indexed-at type="dateTime">2026-09-19T06:00:19Z</structure-indexed-at>
</compound>
