<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">365421</id>
  <title nil="true"/>
  <common-name>Bis(2-chloroethyl) (1-oxo-2,6,7-trioxa-1lambda5-phosphabicyclo[2.2.2]octan-4-yl)methyl phosphate</common-name>
  <description>Bis(2-chloroethyl) (1-oxo-2,6,7-trioxa-1lambda5-phosphabicyclo[2.2.2]octan-4-yl)methyl phosphate is a chemical compound with the formula C9H16Cl2O8P2. It has an average molecular weight of 385.07 g/mol.</description>
  <cas>63451-46-7</cas>
  <pubchem-id>112667</pubchem-id>
  <chemical-formula>C9H16Cl2O8P2</chemical-formula>
  <weight>385.07</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">2026-09-01T15:59:35Z</created-at>
  <updated-at type="dateTime">2026-09-01T15:59:35Z</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>C1C2(COP(=O)(O1)OC2)COP(=O)(OCCCl)OCCCl</moldb-smiles>
  <moldb-formula>C9H16Cl2O8P2</moldb-formula>
  <moldb-inchi>InChI=1S/C9H16Cl2O8P2/c10-1-3-14-20(12,15-4-2-11)16-5-9-6-17-21(13,18-7-9)19-8-9/h1-8H2</moldb-inchi>
  <moldb-inchikey>GFBXHAARYSFJKM-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">383.9697468</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>-0.3</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>CHEM361314</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>Bis(2-chloroethyl) (1-oxo-2,6,7-trioxa-1lambda5-phosphabicyclo[2.2.2]octan-4-yl)methyl 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" nil="true"/>
  <sync-id>CED0315375</sync-id>
  <structure-inchikey>GFBXHAARYSFJKM-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>40000000000000000c00000000000000000000000000080000000000000000000000000000000000000000000000000000000000000000000020002000000000000000810000000000000000000000020808000000100000000000000000040000000002000000000000000000000000000020000000000000000000000000000000008400000000004000000008000000000004000020080000000000000000402000000000400000000000000000004000000008000000000000000000000000000000000000000000000000000000010000000080000002000000000000000000000000000000000000000800000000000000000000000000000000000</structure-fingerprint>
  <structure-pattern-fingerprint>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</structure-pattern-fingerprint>
  <structure-pickle>ï¾­Þ������������������������€���`������� ������`������� ������ ������(������� ������ ������`�������`������� ������ ������(������� ������`�������`������� ������ ������`�������`������� �������������������������������	�	
�
����������������������������������B�����������������������������������</structure-pickle>
  <structure-indexed-at type="dateTime">2026-09-19T06:01:29Z</structure-indexed-at>
</compound>
