<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">365103</id>
  <title nil="true"/>
  <common-name>(4-hydroxyphenyl)-trimethylazanium</common-name>
  <description>(4-hydroxyphenyl)-trimethylazanium is a chemical compound with the formula C9H14NO+. It has an average molecular weight of 152.21 g/mol.</description>
  <cas>13100-87-3</cas>
  <pubchem-id>23041</pubchem-id>
  <chemical-formula>C9H14NO+</chemical-formula>
  <weight>152.21</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">2026-09-01T15:32:52Z</created-at>
  <updated-at type="dateTime">2026-09-01T15:32:52Z</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>C[N+](C)(C)C1=CC=C(C=C1)O</moldb-smiles>
  <moldb-formula>C9H14NO+</moldb-formula>
  <moldb-inchi>InChI=1S/C9H13NO/c1-10(2,3)8-4-6-9(11)7-5-8/h4-7H,1-3H3/p+1</moldb-inchi>
  <moldb-inchikey>FXKOEYONRSTWCP-UHFFFAOYSA-O</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">152.1075391</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>1.5</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>CHEM360996</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>(4-hydroxyphenyl)-trimethylazanium</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>Aniline and substituted anilines</subklass>
  <paper-count type="integer" nil="true"/>
  <sync-id>CED0315062</sync-id>
  <structure-inchikey>FXKOEYONRSTWCP-UHFFFAOYSA-O</structure-inchikey>
  <structure-fingerprint>100000000000000000000000000000000000000000000000002000000000000000000000000000000000000000000000010000008000010000000000000000000000040000000000000010000000000000000000000000000000000000000000000000000000000000040000000000000000000000000000000000000000000000000000000000000004000000000000000080000000800000000000000000000000000000000000000000000002000000000000000000000000000000000000200010020000000000000000000000040000000000000000000000000000000000000000000</structure-fingerprint>
  <structure-pattern-fingerprint>100000000902020080000000000820000000040000040000002000400200000c40000050008000000000010000800000042000a0008c20010000443000a0400084110400020006000090100000620000000005804000003200000420000201000c00040600408200000000004010000120008010010180045118000000310002004000080c4000000800020008000008100c0012440014020000080000000080004300001000400000000800003c201002c00000804108401000020000400210001000c4044000020180000000010080000000000000400000000000080000000000001000000000000000020010200000100010004000020008000050000400</structure-pattern-fingerprint>
  <structure-pickle>ï¾­Þ������������������������€���`������ "�������`�������`������@(������@h�������@h�������@(������@h�������@h��������h���������������������h���h���h���h��	h��
 	�h�B������	��������������</structure-pickle>
  <structure-indexed-at type="dateTime">2026-09-19T06:01:17Z</structure-indexed-at>
</compound>
