<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">79710</id>
  <title nil="true"/>
  <common-name>6,6'-(Ethylenebis(oxy))bis(1,3,5-triazine-2,4-diamine)</common-name>
  <description nil="true"/>
  <cas>84522-04-3</cas>
  <pubchem-id>14848162</pubchem-id>
  <chemical-formula>C8H12N10O2</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">2026-04-04T14:44:58Z</created-at>
  <updated-at type="dateTime">2026-04-04T14:44:58Z</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>NC1=NC(OCCOC2=NC(N)=NC(N)=N2)=NC(N)=N1</moldb-smiles>
  <moldb-formula>C8H12N10O2</moldb-formula>
  <moldb-inchi>InChI=1S/C8H12N10O2/c9-3-13-4(10)16-7(15-3)19-1-2-20-8-17-5(11)14-6(12)18-8/h1-2H2,(H4,9,10,13,15,16)(H4,11,12,14,17,18)</moldb-inchi>
  <moldb-inchikey>OGRXIYGLBKRIJG-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal">280.252</moldb-average-mass>
  <moldb-mono-mass type="decimal">280.11447</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp nil="true"/>
  <hmdb-id nil="true"/>
  <chembl-id nil="true"/>
  <chemspider-id>21164200</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>CHEM075603</chemdb-id>
  <dsstox-id>DTXSID50233508</dsstox-id>
  <toxcast-id nil="true"/>
  <stoff-ident-origin nil="true"/>
  <stoff-ident-id nil="true"/>
  <susdat-id>NS00038525</susdat-id>
  <iupac>6-[2-[(4,6-diamino-1,3,5-triazin-2-yl)oxy]ethoxy]-1,3,5-triazine-2,4-diamine</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">0</paper-count>
  <sync-id>CED0115770</sync-id>
  <structure-inchikey>OGRXIYGLBKRIJG-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>4000000000000000080000000000000000000000000000000000000000000000000000000000000000000000000200000004000000000000000000000000000000000000000c000000000000000000000000008000100000400000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000001000000000000000008000000000000000000000000000000000080000000100000000084000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000001000000000800000000000000000000000000000000000000</structure-fingerprint>
  <structure-pattern-fingerprint>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</structure-pattern-fingerprint>
  <structure-pickle>ï¾­Þ������������������������€���h�������@(������@(������@(�������(�������`�������`�������(������@(������@(������@(�������h�������@(������@(�������h�������@(������@(������@(�������h�������@(�������� ��h���h��� ����������� �	h�	
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  <structure-indexed-at type="dateTime">2026-09-19T04:26:48Z</structure-indexed-at>
</compound>
