360839 <common-name>Diethyl [methoxy(methylsulfanyl)phosphoryl] phosphate</common-name> <description nil="true"/> <cas nil="true"/> <pubchem-id>201152</pubchem-id> <chemical-formula>C6H16O6P2S</chemical-formula> <weight>278.2</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">2026-09-01T09:27:40Z</created-at> <updated-at type="dateTime">2026-09-01T09:27:40Z</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)OP(=O)(OC)SC</moldb-smiles> <moldb-formula>C6H16O6P2S</moldb-formula> <moldb-inchi>InChI=1S/C6H16O6P2S/c1-5-10-13(7,11-6-2)12-14(8,9-3)15-4/h5-6H2,1-4H3</moldb-inchi> <moldb-inchikey>XUQMJWHBMXWRCI-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">278.0142834</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>0.1</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>CHEM356732</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>Diethyl [methoxy(methylsulfanyl)phosphoryl] phosphate</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 phosphoric acids and derivatives</klass> <subklass>Phosphate esters</subklass> <paper-count type="integer">25</paper-count> <sync-id>CED0028213</sync-id> <structure-inchikey>XUQMJWHBMXWRCI-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>8100000008000000000000000000800000000000000000000000020000000000000000000000002000000000000000000000022008000000000000000000000000400000000000200000000001000000000000000000000000000000000000c0000000000000000000000000000000000000000000000000000040000000000000000000000000000000000010020000020000000000000000000000000000000000000000000000000200000000000000000000000000000000000000000000000000000000000000000000080008000000000000000000000100000000000000000000200000000002000000000000000000000000</structure-fingerprint> <structure-pattern-fingerprint>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</structure-pattern-fingerprint> <structure-pickle>ï¾­Þ������������������������€���`�������`������� ������ ������(������� ������`�������`������� ������ ������(������� ������`������� ������`�������������������������������� � �� ����� � ��B��������������</structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T05:58:15Z</structure-indexed-at> </compound>