<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">362556</id>
  <title nil="true"/>
  <common-name>2-[[4-methyl-6-(trifluoromethyl)-1,3,5-triazin-2-yl]amino]ethanol</common-name>
  <description>2-[[4-methyl-6-(trifluoromethyl)-1,3,5-triazin-2-yl]amino]ethanol is a compound with the chemical formula C7H9F3N4O. It has an average molecular weight of 222.17 g/mol.</description>
  <cas>58892-34-5</cas>
  <pubchem-id>3041948</pubchem-id>
  <chemical-formula>C7H9F3N4O</chemical-formula>
  <weight>222.17</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">2026-09-01T11:51:04Z</created-at>
  <updated-at type="dateTime">2026-09-01T11:51:04Z</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=NC(=NC(=N1)NCCO)C(F)(F)F</moldb-smiles>
  <moldb-formula>C7H9F3N4O</moldb-formula>
  <moldb-inchi>InChI=1S/C7H9F3N4O/c1-4-12-5(7(8,9)10)14-6(13-4)11-2-3-15/h15H,2-3H2,1H3,(H,11,12,13,14)</moldb-inchi>
  <moldb-inchikey>LQXCPZODGZUKED-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">222.0728454</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>0.9</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>CHEM358449</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-[[4-methyl-6-(trifluoromethyl)-1,3,5-triazin-2-yl]amino]ethanol</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>Triazines</klass>
  <subklass>Aminotriazines</subklass>
  <paper-count type="integer" nil="true"/>
  <sync-id>CED0312617</sync-id>
  <structure-inchikey>LQXCPZODGZUKED-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>4000080000000202000000000000000000000000a000000000000000000000000000000000000002000000000000000000020004000000000000000040000000000000000000000000000001000000000000010000000000000000000014000000000000000000000000000000000000000000000000000000000000040000000000000000200000080000000000080000000000000000000000000000000000000000000080000000080000000040001000000000000000000000000000200000000000000000000000000200000002000000000000000000000000000000001000000000000000000800000004000000000000000000002</structure-fingerprint>
  <structure-pattern-fingerprint>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</structure-pattern-fingerprint>
  <structure-pickle>ï¾­Þ������������������������€���`������@(������@(������@(������@(������@(������@(�������h��������`�������`�������`������� ����	� ����	� ����	� ����������h���h���h���h���h��� ����	�	
��������������h�B���������������������</structure-pickle>
  <structure-indexed-at type="dateTime">2026-09-19T05:59:32Z</structure-indexed-at>
</compound>
