<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">337730</id>
  <title nil="true"/>
  <common-name>Tris(3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctyl) borate</common-name>
  <description>Tris(3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctyl) borate is a chemical compound with the formula C24H12BF39O3. With an average molecular weight of 1,100 g/mol, Tris(3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctyl) borate is a heavy molecule.</description>
  <cas>213974-85-7</cas>
  <pubchem-id>18329245</pubchem-id>
  <chemical-formula>C24H12BF39O3</chemical-formula>
  <weight>1100.1</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">2026-08-30T20:40:58Z</created-at>
  <updated-at type="dateTime">2026-08-30T20:40:58Z</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>B(OCCC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(OCCC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)OCCC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F</moldb-smiles>
  <moldb-formula>C24H12BF39O3</moldb-formula>
  <moldb-inchi>InChI=1S/C24H12BF39O3/c26-7(27,10(32,33)13(38,39)16(44,45)19(50,51)22(56,57)58)1-4-65-25(66-5-2-8(28,29)11(34,35)14(40,41)17(46,47)20(52,53)23(59,60)61)67-6-3-9(30,31)12(36,37)15(42,43)18(48,49)21(54,55)24(62,63)64/h1-6H2</moldb-inchi>
  <moldb-inchikey>OLNZYRAJMGESGX-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">1100.025673</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>CHEM333623</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>Tris(3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctyl) borate</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 oxygen compounds</superklass>
  <klass>Organic oxoanionic compounds</klass>
  <subklass nil="true"/>
  <paper-count type="integer">1</paper-count>
  <sync-id>CED0060292</sync-id>
  <structure-inchikey>OLNZYRAJMGESGX-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>40000000000100000800000002000000000000000000000000000000000000001000000000000000000000000000000000000000000000000000000000000000002000000000000000008000010100000000000000100000000000000200000000000000000000000000000000200000008000000000000080000000000000000000800000000000000000000000000000200000000000000000000010000000000080000000000000000000002000000000000040000000000000000000000000000000000000000000000000000000000200000000000000000000000000000000000000000000000000000000000800000000000000000000000000000</structure-fingerprint>
  <structure-pattern-fingerprint>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</structure-pattern-fingerprint>
  <structure-pickle>ï¾­Þ����������������C���B���€���(������� ������`�������`������� ������ ������ ������ ������ ������ ����	� ����	� ����	� ����	� ����	� ����	� ����	� ����	� ����	� ����	� ����	� ����	� ����	� ������ ������`�������`������� ������ ������ ������ ������ ������ ����	� ����	� ����	� ����	� ����	� ����	� ����	� ����	� ����	� ����	� ����	� ����	� ����	� ������ ������`�������`������� ������ ������ ������ ������ ������ ����	� ����	� ����	� ����	� ����	� ����	� ����	� ����	� ����	� ����	� ����	� ����	� ����	� ������������������������������	�	
�	��	����������������������������������������������������������� ��!��"��#��$��%��&amp;��'��(��)��*��+��,��-�-.�./�/0�01�12�23�34�45�56�57�58�49�4:�3;�3&lt;�2=�2&gt;�1?�1@�0A�0B�B��������������</structure-pickle>
  <structure-indexed-at type="dateTime">2026-09-19T05:38:44Z</structure-indexed-at>
</compound>
