<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">79824</id>
  <title nil="true"/>
  <common-name>4-(Bis(phenylmethyl)amino)-3-ethoxybenzenediazonium tetrafluoroborate</common-name>
  <description>4-(Bis(phenylmethyl)amino)-3-ethoxybenzenediazonium tetrafluoroborate belongs to the phenylmethylamines, a subclass of benzene and substituted derivatives within the organic compounds. It is a member of the benzenoids superclass with the chemical formula C22H22N3O1 and an average molecular weight of 431.24 g/mol.</description>
  <cas>84788-07-8</cas>
  <pubchem-id>16205524</pubchem-id>
  <chemical-formula>C22H22N3O1</chemical-formula>
  <weight nil="true"/>
  <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">2026-04-04T15:06:36Z</created-at>
  <updated-at type="dateTime">2026-04-04T15:06:36Z</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>F[B-](F)(F)F.CCOC1=C(C=CC(=C1)[N+]#N)N(CC1=CC=CC=C1)CC1=CC=CC=C1</moldb-smiles>
  <moldb-formula>C22H22N3O1</moldb-formula>
  <moldb-inchi>InChI=1S/C22H22N3O/c1-2-26-22-15-20(24-23)13-14-21(22)25(16-18-9-5-3-6-10-18)17-19-11-7-4-8-12-19/h3-15H,2,16-17H2,1H3/q+1</moldb-inchi>
  <moldb-inchikey>NQMXZPCBBPPFGL-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal">431.24</moldb-average-mass>
  <moldb-mono-mass type="decimal">344.176287</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp nil="true"/>
  <hmdb-id nil="true"/>
  <chembl-id nil="true"/>
  <chemspider-id>17333725</chemspider-id>
  <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>CHEM075717</chemdb-id>
  <dsstox-id>DTXSID50233826</dsstox-id>
  <toxcast-id nil="true"/>
  <stoff-ident-origin nil="true"/>
  <stoff-ident-id nil="true"/>
  <susdat-id>NS00038651</susdat-id>
  <iupac>4-(dibenzylamino)-3-ethoxybenzenediazonium;tetrafluoroborate</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>Phenylmethylamines</subklass>
  <paper-count type="integer">0</paper-count>
  <sync-id>CED0169764</sync-id>
  <structure-inchikey>NQMXZPCBBPPFGL-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>100000200000000800000000000000010000000000000000000000400000000008002002000000000040000000004000000004000000000000001000010000000000000000000000000000000000000000000000110000000008000000000000000000000000000040000104000000000000000000000000000000000000000000040200000800000000000001000000000000100000000020000800000000000000000000000000000088000000000000000080000000000020000000000000000000000000000000000000000000001000000040000000220000000000000000000000000000040000000008000800000400020000100000020000000</structure-fingerprint>
  <structure-pattern-fingerprint>501000040d320240810019408128a000000004008105200000352040822408cc4c020050118000000000410800800000046002a5408d32010024643100a04010c6110c00028806000090504000720200005405805121193240000422400241000c20052e0048820048008400d5b4000d208880500101e1045118000002710002104000080ef0820808020250482c0008191d081244001c82100008200040008000cb10101090c00000000860017c35100ac000008941084010000a1008c00212a01000e404c00032018084004401029008000000020050000d4000000800030090004010088100001000000340122080025000308442040e0008100050000602</structure-pattern-fingerprint>
  <structure-pickle type="binary" encoding="base64">776t3gAAAAAQAAAAAwAAAAAAAAAfAAAAIAAAAIABCQAgAAAAAQUgIgAAAP8E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</structure-pickle>
  <structure-indexed-at type="dateTime">2026-09-19T04:26:53Z</structure-indexed-at>
</compound>
