95310 <common-name>6-Amino-5-[(4-aminophenyl)azo]-4-hydroxynaphthalene-2-sulphonic acid</common-name> <description nil="true"/> <cas nil="true"/> <pubchem-id>108844</pubchem-id> <chemical-formula>C16H14N4O4S</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">2026-04-05T03:17:54Z</created-at> <updated-at type="dateTime">2026-08-28T17:35:00Z</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=CC=C(NNC2=C3C(=O)C=C(C=C3C=CC2=N)S(O)(=O)=O)C=C1</moldb-smiles> <moldb-formula>C16H14N4O4S</moldb-formula> <moldb-inchi>InChI=1/C16H14N4O4S/c17-10-2-4-11(5-3-10)19-20-16-13(18)6-1-9-7-12(25(22,23)24)8-14(21)15(9)16/h1-8,21H,17-18H2,(H,22,23,24)</moldb-inchi> <moldb-inchikey>SEBMYYJEJZOW-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal">358.37</moldb-average-mass> <moldb-mono-mass type="decimal">358.0735759</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>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>CHEM091203</chemdb-id> <dsstox-id>DTXSID50975234</dsstox-id> <toxcast-id nil="true"/> <stoff-ident-origin nil="true"/> <stoff-ident-id nil="true"/> <susdat-id>NS00057265</susdat-id> <iupac>6-amino-5-[(4-aminophenyl)diazenyl]-4-hydroxynaphthalene-2-sulfonic acid</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>Benzenoids</superklass> <klass>Benzene and substituted derivatives</klass> <subklass>Phenylhydrazines</subklass> <paper-count type="integer">0</paper-count> <sync-id>CED0108356</sync-id> <structure-inchikey>USUBAMXJIFCVMD-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>80080000000000000000000000000100080000000000000000000000000020000000020000000000000000000000200000000000000000000000001400000000008000000120010020000000000000000200000010200000000000010000000010000000000080000000000000800000000000000000000000000000080100000000000000000080009000000000000000000000000000000000000000000400000000080000000000020200004000080000000000000000000000000000200000004000000000000000100000000000040200000000000008000000000800000040004000000000000000000000000000000042000000</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��� �� B������������ �� �������������������</structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T04:36:20Z</structure-indexed-at> </compound>