<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">277158</id>
  <title nil="true"/>
  <common-name>Dibutyl-[dibutyl-(2,4,5-trichlorophenoxy)stannyl]oxy-(2,4,5-trichlorophenoxy)stannane</common-name>
  <description>Dibutyl-[dibutyl-(2,4,5-trichlorophenoxy)stannyl]oxy-(2,4,5-trichlorophenoxy)stannane belongs to the phenoxy compounds, a subclass of benzene and substituted derivatives within the organic compounds. It is categorized under the superclass of benzenoids and has the formula C28H40Cl6O3Sn2. With an average molecular weight of 874.70 g/mol, Dibutyl-[dibutyl-(2,4,5-trichlorophenoxy)stannyl]oxy-(2,4,5-trichlorophenoxy)stannane is a heavy molecule.</description>
  <cas>74007-80-0</cas>
  <pubchem-id>16683062</pubchem-id>
  <chemical-formula>C28H40Cl6O3Sn2</chemical-formula>
  <weight>874.7</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">2026-08-26T16:58:29Z</created-at>
  <updated-at type="dateTime">2026-08-26T16:58:29Z</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>CCCC[Sn](CCCC)(OC1=CC(=C(C=C1Cl)Cl)Cl)O[Sn](CCCC)(CCCC)OC2=CC(=C(C=C2Cl)Cl)Cl</moldb-smiles>
  <moldb-formula>C28H40Cl6O3Sn2</moldb-formula>
  <moldb-inchi>InChI=1S/2C6H3Cl3O.4C4H9.O.2Sn/c2*7-3-1-5(9)6(10)2-4(3)8;4*1-3-4-2;;;/h2*1-2,10H;4*1,3-4H2,2H3;;;/q;;;;;;;2*+1/p-2</moldb-inchi>
  <moldb-inchikey>YXTCSFKFQSYNGA-UHFFFAOYSA-L</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">873.91527</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp nil="true"/>
  <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>CHEM273051</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>Dibutyl-[dibutyl-(2,4,5-trichlorophenoxy)stannyl]oxy-(2,4,5-trichlorophenoxy)stannane</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>Benzenoids</superklass>
  <klass>Benzene and substituted derivatives</klass>
  <subklass>Phenoxy compounds</subklass>
  <paper-count type="integer" nil="true"/>
  <sync-id>CED0229328</sync-id>
  <structure-inchikey>YXTCSFKFQSYNGA-UHFFFAOYSA-L</structure-inchikey>
  <structure-fingerprint>800040000000000100000000000000000000000000000000000002000000000000000002000000000000000000000000000000000020000000000400400000010000000000000000000040000100000000000000000000000020000000000000000000100000000000000000000000000000000000000000000040000000000002000000040000000000080000000000000000000000000000000000000000002000080000000000000001000000000000000000000000002000000000000000000000000000000010000000000000020000000000808000000000000000000040000000010000000000000020000000000000000800</structure-fingerprint>
  <structure-pattern-fingerprint>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</structure-pattern-fingerprint>
  <structure-pickle>ï¾­Þ����������������'���(���€���`�������`�������`�������`�����2  ������`�������`�������`�������`�������(������@(������@h�������@(������@(������@h�������@(������� ������ ������ ������ ����2  ������`�������`�������`�������`�������`�������`�������`�������`�������(������@(������@h�������@(������@(������@h�������@(������� ������ ������ ������������������������������	�	
 
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  <structure-indexed-at type="dateTime">2026-09-19T04:52:53Z</structure-indexed-at>
</compound>
