365637 <common-name>4-pentyl-2,6,7-trioxa-1lambda5-phosphabicyclo[2.2.2]octane 1-oxide</common-name> <description>4-pentyl-2,6,7-trioxa-1lambda5-phosphabicyclo[2.2.2]octane 1-oxide is a chemical compound with the formula C9H17O4P. It has an average molecular weight of 220.20 g/mol.</description> <cas>52940-84-8</cas> <pubchem-id>3040778</pubchem-id> <chemical-formula>C9H17O4P</chemical-formula> <weight>220.2</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">2026-09-01T16:21:48Z</created-at> <updated-at type="dateTime">2026-09-01T16:21:48Z</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>CCCCCC12COP(=O)(OC1)OC2</moldb-smiles> <moldb-formula>C9H17O4P</moldb-formula> <moldb-inchi>InChI=1S/C9H17O4P/c1-2-3-4-5-9-6-11-14(10,12-7-9)13-8-9/h2-8H2,1H3</moldb-inchi> <moldb-inchikey>UEAXNVANDLGABW-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">220.086446</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>1.7</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>CHEM361530</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>4-pentyl-2,6,7-trioxa-1lambda5-phosphabicyclo[2.2.2]octane 1-oxide</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 nil="true"/> <paper-count type="integer" nil="true"/> <sync-id>CED0315585</sync-id> <structure-inchikey>UEAXNVANDLGABW-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>800000000000000000000000000000000100000000000000000002000000000000000000000000000000000000000000000000000000000000000800000000010000000000000020808000000000000000000000000000000030002000000000000000008000000000020000000000000000000000000000000048000000000000000000008000000000004000000080000000000000000400000000000400000000000000001000000008000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000810000000000000000000000000000000000</structure-fingerprint> <structure-pattern-fingerprint>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</structure-pattern-fingerprint> <structure-pickle>ï¾­Þ������������������������€���`�������`�������`�������`�������`������� ������`������� ������ ������(������� ������`������� ������`������������������������������� ��� � ������ ���� ��B�������� ������� �� �� ������������</structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T06:01:41Z</structure-indexed-at> </compound>