285250 <common-name>Ethoxy-(3-methyl-4-nitrophenoxy)-propan-2-yloxy-sulfanylidene-lambda5-phosphane</common-name> <description>Ethoxy-(3-methyl-4-nitrophenoxy)-propan-2-yloxy-sulfanylidene-lambda5-phosphane belongs to the thiophosphoric acid esters, a subclass of organic thiophosphoric acids and derivatives within the organic compounds. It has the formula C12H18NO5PS and an average molecular weight of 319.32 g/mol.</description> <cas>22371-93-3</cas> <pubchem-id>123400</pubchem-id> <chemical-formula>C12H18NO5PS</chemical-formula> <weight>319.32</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">2026-08-27T20:57:19Z</created-at> <updated-at type="dateTime">2026-08-27T20:57:19Z</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=CC(=C(C=C1)[N+](=O)[O-])C)OC(C)C</moldb-smiles> <moldb-formula>C12H18NO5PS</moldb-formula> <moldb-inchi>InChI=1S/C12H18NO5PS/c1-5-16-19(20,17-9(2)3)18-11-6-7-12(13(14)15)10(4)8-11/h6-9H,5H2,1-4H3</moldb-inchi> <moldb-inchikey>HBMCHNPSLBWODD-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">319.0643309</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>4.5</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>CHEM281143</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>Ethoxy-(3-methyl-4-nitrophenoxy)-propan-2-yloxy-sulfanylidene-lambda5-phosphane</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>CED0237079</sync-id> <structure-inchikey>HBMCHNPSLBWODD-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>40000080000000000000800040000000000000000000000080000000000000000000001006000000200000002000000000000000000000000000000000000000000000000000000000000400000000000020000000000100001a00000001400000000001000000000200000000100000000000000200000000000000000000000000000050000000000000000000000000000000001018000000020000000000000000000000000008000000080100000000000000000000000000000000000000000000000000000000000000000000000000000100082040000200000000400000000000000800000040000000000000000000021000200000000000000000</structure-fingerprint> <structure-pattern-fingerprint>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</structure-pattern-fingerprint> <structure-pickle>ï¾­Þ������������������������€���`�������`������� ������ ������(�������(������@(������@h�������@(������@(������@h�������@h������� *��������(������ *���ÿ����`������� ������`�������`�������`������������������������ ��h���h�� h� h� �h� � � (��� �����������������h�B������� ������������</structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T04:59:17Z</structure-indexed-at> </compound>