<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">96492</id>
  <title nil="true"/>
  <common-name>3,3'-[Carbonylbis[imino(5-methoxy-2-methyl-p-phenylene)azo]]bis[N,N,N-trimethylanilinium] dichloride</common-name>
  <description>3,3'-[Carbonylbis[imino(5-methoxy-2-methyl-p-phenylene)azo]]bis[N,N,N-trimethylanilinium] dichloride belongs to the azobenzenes, a class of organoheterocyclic compounds within the organic compounds. With an average molecular weight of 695.69 g/mol, 3,3'-[Carbonylbis[imino(5-methoxy-2-methyl-p-phenylene)azo]]bis[N,N,N-trimethylanilinium] dichloride is a heavy molecule. Its chemical formula is C35H44N8O3.</description>
  <cas nil="true"/>
  <pubchem-id>71440456</pubchem-id>
  <chemical-formula>C35H44N8O3</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">2026-04-05T04:22:42Z</created-at>
  <updated-at type="dateTime">2026-04-05T04:22:42Z</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>[Cl-].[Cl-].COC1=CC(N=NC2=CC(=CC=C2)[N+](C)(C)C)=C(C)C=C1NC(=O)NC1=C(OC)C=C(N=NC2=CC(=CC=C2)[N+](C)(C)C)C(C)=C1</moldb-smiles>
  <moldb-formula>C35H44N8O3</moldb-formula>
  <moldb-inchi>InChI=1/C35H43N8O3.2ClH/c1-23-17-31(40-38-25-13-11-15-27(19-25)42(3,4)5)33(45-9)21-29(23)36-35(44)37-30-22-34(46-10)32(18-24(30)2)41-39-26-14-12-16-28(20-26)43(6,7)8;;/h11-22H,1-10H3,(H-,36,37,38,39,44);2*1H/q+1;;/p-1</moldb-inchi>
  <moldb-inchikey>WVFOCBZFSWTKAQ-UHFFFAOYSA-M</moldb-inchikey>
  <moldb-average-mass type="decimal">695.69</moldb-average-mass>
  <moldb-mono-mass type="decimal">624.3536373</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp nil="true"/>
  <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>CHEM092385</chemdb-id>
  <dsstox-id>DTXSID5072856</dsstox-id>
  <toxcast-id nil="true"/>
  <stoff-ident-origin nil="true"/>
  <stoff-ident-id nil="true"/>
  <susdat-id>NS00058609</susdat-id>
  <iupac nil="true"/>
  <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>Azobenzenes</klass>
  <subklass nil="true"/>
  <paper-count type="integer">0</paper-count>
  <sync-id>CED0183152</sync-id>
  <structure-inchikey>BQXFWIOWXSQKPF-UHFFFAOYSA-M</structure-inchikey>
  <structure-fingerprint>402000000000800000000000000000000000000000000000000000000000400000000000000000000000000000000000000002000000000000000000000000080000000000000400000010000008000030000020000100000004000000000000000000010000000040000000100000000000001000000000000000000000100001000060000002800000200000000080000000001000000080000000000000000000000000000000000008080100000000000000000000000001000000000080000000000000000000000000000000000080000000002000000200010000000000008000000002002040000000004400000000000020000410000000000000</structure-fingerprint>
  <structure-pattern-fingerprint>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</structure-pattern-fingerprint>
  <structure-pickle>ï¾­Þ����������������0���1���€�� ����ÿ� ����ÿ��`�������(������@(������@h�������@(�������(�������(������@(������@h�������@(������@h�������@h�������@h������� "�������`�������`�������`������@(�������`������@h�������@(�������h��������(�������(�������h�������@(������@(�������(�������`������@h�������@(�������(�������(������@(������@h�������@(������@h�������@h�������@h������� "�������`�������`�������`������@(�������`������@h������������ ��h���h��� ��(��	 	
h�
�h���h��h��h���������������h������h���h��� �� ��(��� �� ��h��� �����h�� h� ! !"(�"# #$h�$%h�%&amp;h�&amp;'h�'(h�%)�)*�)+�),� -h�-.�-/h���h�/�h��	h�(#h�B������������
���	��� -/��$%&amp;'(#����������</structure-pickle>
  <structure-indexed-at type="dateTime">2026-09-19T04:37:04Z</structure-indexed-at>
</compound>
