<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">325691</id>
  <title nil="true"/>
  <common-name>Triphenyl-[[(2,2,2-trifluoroacetyl)amino]methyl]phosphanium</common-name>
  <description>Triphenyl-[[(2,2,2-trifluoroacetyl)amino]methyl]phosphanium is a compound with the formula C21H18F3NOP+. It has an average molecular weight of 388.30 g/mol.</description>
  <cas nil="true"/>
  <pubchem-id>3507856</pubchem-id>
  <chemical-formula>C21H18F3NOP+</chemical-formula>
  <weight>388.3</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">2026-08-30T03:36:58Z</created-at>
  <updated-at type="dateTime">2026-08-30T03:36:58Z</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>C1=CC=C(C=C1)[P+](CNC(=O)C(F)(F)F)(C2=CC=CC=C2)C3=CC=CC=C3</moldb-smiles>
  <moldb-formula>C21H18F3NOP+</moldb-formula>
  <moldb-inchi>InChI=1S/C21H17F3NOP/c22-21(23,24)20(26)25-16-27(17-10-4-1-5-11-17,18-12-6-2-7-13-18)19-14-8-3-9-15-19/h1-15H,16H2/p+1</moldb-inchi>
  <moldb-inchikey>CRMBNXSUWGUDRD-UHFFFAOYSA-O</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">388.1078107</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>5.2</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>CHEM321584</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>Triphenyl-[[(2,2,2-trifluoroacetyl)amino]methyl]phosphanium</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>Phenylphosphines and derivatives</subklass>
  <paper-count type="integer" nil="true"/>
  <sync-id>CED0276319</sync-id>
  <structure-inchikey>CRMBNXSUWGUDRD-UHFFFAOYSA-O</structure-inchikey>
  <structure-fingerprint>40000000000000000000800000002000000000000040000004000000000002000000000000000000000000000000000004000000000000000000000000200000000000000000000000000002000000000020000000000000000000000000000000000000010000000000000000000000800000000000000000000000000000000000000000040000800000000000000080000000000100000000000000000800000000000000000080000000080000000000000000040000000000000000000000000000000000000000000000000000000000000000000000000200000000000000000000020000000044000000000400800200000000000004000000000000</structure-fingerprint>
  <structure-pattern-fingerprint>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</structure-pattern-fingerprint>
  <structure-pickle>ï¾­Þ������������������������€��@h�������@h�������@h�������@(������@h�������@h������� "�������`�������h��������(�������(������� ����	� ����	� ����	� �����@(������@h�������@h�������@h�������@h�������@h�������@(������@h�������@h�������@h�������@h�������@h���������h���h���h���h���h�����������	 	
(�	���������������h���h���h���h���h������h���h���h���h���h���h���h���h�B�����������������������������������</structure-pickle>
  <structure-indexed-at type="dateTime">2026-09-19T05:29:32Z</structure-indexed-at>
</compound>
