<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">291316</id>
  <title nil="true"/>
  <common-name>2-[(e)-(2,6-dimethylpyridin-1-ium-1-yl)iminomethyl]phenol</common-name>
  <description>2-[(e)-(2,6-dimethylpyridin-1-ium-1-yl)iminomethyl]phenol belongs to the carbonyl compounds, a subclass of organooxygen compounds within the organic compounds. This organic oxygen compound has the chemical formula C14H15N2O+ and an average molecular weight of 227.28 g/mol.</description>
  <cas nil="true"/>
  <pubchem-id>135583285</pubchem-id>
  <chemical-formula>C14H15N2O+</chemical-formula>
  <weight>227.28</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">2026-08-28T05:56:25Z</created-at>
  <updated-at type="dateTime">2026-08-28T05:56:25Z</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>CC1=[N+](C(=CC=C1)C)N=CC2=CC=CC=C2O</moldb-smiles>
  <moldb-formula>C14H15N2O+</moldb-formula>
  <moldb-inchi>InChI=1S/C14H14N2O/c1-11-6-5-7-12(2)16(11)15-10-13-8-3-4-9-14(13)17/h3-10H,1-2H3/p+1</moldb-inchi>
  <moldb-inchikey>CBEVBMZNPUVRQV-UHFFFAOYSA-O</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">227.1184381</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>3.2</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>CHEM287209</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>2-[(e)-(2,6-dimethylpyridin-1-ium-1-yl)iminomethyl]phenol</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>Organooxygen compounds</klass>
  <subklass>Carbonyl compounds</subklass>
  <paper-count type="integer" nil="true"/>
  <sync-id>CED0242890</sync-id>
  <structure-inchikey>CBEVBMZNPUVRQV-UHFFFAOYSA-O</structure-inchikey>
  <structure-fingerprint>40000000000000000000000000002000040000000000000000000000000000000020000000004400001000000000000000000000000000000000000000000000000000000000200000004000000000000000000010000000000000080000000000000000002000440000000000000000001000040000000800000000000000000000000000900000000000000000000000000000000000000000000080000000000000000000000000000000000000000000000000000002100000000000000000000000000002000000200000000000000000001002000000440000000000000000000000000000000000000000000</structure-fingerprint>
  <structure-pattern-fingerprint>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</structure-pattern-fingerprint>
  <structure-pickle type="binary" encoding="base64">776t3gAAAAAQAAAAAwAAAAAAAAARAAAAEgAAAIABBgBgAAAAAQMGQCgAAAAD
BAdgKgAAAAEDBAZAKAAAAAMEBkBoAAAAAwMBBkBoAAAAAwMBBkBoAAAAAwMB
BgBgAAAAAQMHACgAAAADAwYAaAAAAAMDAQZAKAAAAAMEBkBoAAAAAwMBBkBo
AAAAAwMBBkBoAAAAAwMBBkBoAAAAAwMBBkAoAAAAAwQIAGgAAAADAQELAAEA
AQJoDAIDaAwDBGgMBAVoDAUGaAwDBwACCCAICSgCCQogCgtoDAsMaAwMDWgM
DQ5oDA4PaAwPECAGAWgMDwpoDEICAAAABgEGBQQDAgYLDA0ODwoXBAAAAAAA
AAAW
</structure-pickle>
  <structure-indexed-at type="dateTime">2026-09-19T05:03:42Z</structure-indexed-at>
</compound>
