<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">294722</id>
  <title nil="true"/>
  <common-name>6-phenyl-2-(trifluoromethyl)-1h-benzimidazole</common-name>
  <description>6-phenyl-2-(trifluoromethyl)-1h-benzimidazole belongs to the benzimidazoles, a class of organoheterocyclic compounds within the organic compounds. This compound has the chemical formula C14H9F3N2 and an average molecular weight of 262.23 g/mol.</description>
  <cas>89426-92-6</cas>
  <pubchem-id>198632</pubchem-id>
  <chemical-formula>C14H9F3N2</chemical-formula>
  <weight>262.23</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">2026-08-28T10:30:24Z</created-at>
  <updated-at type="dateTime">2026-08-28T10:30:24Z</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>C1=CC=C(C=C1)C2=CC3=C(C=C2)N=C(N3)C(F)(F)F</moldb-smiles>
  <moldb-formula>C14H9F3N2</moldb-formula>
  <moldb-inchi>InChI=1S/C14H9F3N2/c15-14(16,17)13-18-11-7-6-10(8-12(11)19-13)9-4-2-1-3-5-9/h1-8H,(H,18,19)</moldb-inchi>
  <moldb-inchikey>JYIRUKAOLZSQJQ-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">262.0717828</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>4.3</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>CHEM290615</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>6-phenyl-2-(trifluoromethyl)-1h-benzimidazole</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>Organoheterocyclic compounds</superklass>
  <klass>Benzimidazoles</klass>
  <subklass nil="true"/>
  <paper-count type="integer" nil="true"/>
  <sync-id>CED0246191</sync-id>
  <structure-inchikey>JYIRUKAOLZSQJQ-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>2100000000000000000000000000000000000000000000000000000001000000042004000000000000000000000000000000000000000000080000000000000000000000000000000000000000008000000000004041004000000000000000100000800000000000000840000000000000000000000000000000804000200000000000800000000100000000000000000000000000000000000000000000080000400000000000040000000000000000000000000000000000000000000000000000000000000000000000004200000000001000000000000001000040000000000000800000000800000000000000000000</structure-fingerprint>
  <structure-pattern-fingerprint>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</structure-pattern-fingerprint>
  <structure-pickle>ï¾­Þ������������������������€��@h�������@h�������@h�������@(������@h�������@h�������@(������@h�������@(������@(������@h�������@h�������@(������@(������@8�������� ����	� ����	� ����	� �������h���h���h���h���h��� ��h���h��	h�	
h�
�h�	�h��h��h��������������h���h���h�B��������������	
����	������������</structure-pickle>
  <structure-indexed-at type="dateTime">2026-09-19T05:06:14Z</structure-indexed-at>
</compound>
