331076 <common-name>4-tert-butyl-2-[(4-phenyldiazenylphenyl)diazenyl]phenol</common-name> <description nil="true"/> <cas nil="true"/> <pubchem-id>79651</pubchem-id> <chemical-formula>C22H22N4O</chemical-formula> <weight>358.4</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">2026-08-30T11:48:09Z</created-at> <updated-at type="dateTime">2026-08-30T11:48:09Z</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>CC(C)(C)C1=CC(=C(C=C1)O)N=NC2=CC=C(C=C2)N=NC3=CC=CC=C3</moldb-smiles> <moldb-formula>C22H22N4O</moldb-formula> <moldb-inchi>InChI=1S/C22H22N4O/c1-22(2,3)16-9-14-21(27)20(15-16)26-25-19-12-10-18(11-13-19)24-23-17-7-5-4-6-8-17/h4-15,27H,1-3H3</moldb-inchi> <moldb-inchikey>BWVSXJCXZQBCNI-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">358.1793613</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>6.8</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>CHEM326969</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-tert-butyl-2-[(4-phenyldiazenylphenyl)diazenyl]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>Organoheterocyclic compounds</superklass> <klass>Azobenzenes</klass> <subklass nil="true"/> <paper-count type="integer" nil="true"/> <sync-id>CED0281616</sync-id> <structure-inchikey>BWVSXJCXZQBCNI-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>2000400000000000000000002000000000000000000000200000000000000000000000000000000000004000000004800000000000000000000000000000000000000000000000000000080000000001000000000000000004000000000000000000010000000000000000100000000000001000000000000000000000000000000040000002800000000000000000000000000100000000000000008000000000000000001000000000080000000040000000000000100001000000000000000000000100002100000000000000400080000000000000000200000000000000000000000002000040000000000000000000000000000000000000000000</structure-fingerprint> <structure-pattern-fingerprint>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</structure-pattern-fingerprint> <structure-pickle>ï¾­Þ������������������������€���`������� ������`�������`������@(������@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�� h���h�B������ ���������� �����������������</structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T05:33:29Z</structure-indexed-at> </compound>