75034 <common-name>Benzenesulfonic acid, 2-amino-3,5-dichloro-4-methyl-</common-name> <description>Benzenesulfonic acid, 2-amino-3,5-dichloro-4-methyl- belongs to the benzenesulfonic acids and derivatives, a subclass of benzene and substituted derivatives within the organic compounds. It has the formula C7H7Cl2N1O3S1 and an average molecular weight of 256.10 g/mol. It is further classified as part of the benzenoids superclass.</description> <cas>51750-32-4</cas> <pubchem-id>103949</pubchem-id> <chemical-formula>C7H7Cl2N1O3S1</chemical-formula> <weight>256.11</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">2026-04-04T02:44:30Z</created-at> <updated-at type="dateTime">2026-08-24T06:32:05Z</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=C(Cl)C(N)=C(C=C1Cl)S(O)(=O)=O</moldb-smiles> <moldb-formula>C7H7Cl2N1O3S1</moldb-formula> <moldb-inchi>InChI=1S/C7H7Cl2NO3S/c1-3-4(8)2-5(14(11,12)13)7(10)6(3)9/h2H,10H2,1H3,(H,11,12,13)</moldb-inchi> <moldb-inchikey>BUURMHBKUUZRFW-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal">256.1</moldb-average-mass> <moldb-mono-mass type="decimal">254.952369</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>2.2</logp> <hmdb-id nil="true"/> <chembl-id nil="true"/> <chemspider-id>93850</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>CHEM070927</chemdb-id> <dsstox-id>DTXSID4068664</dsstox-id> <toxcast-id nil="true"/> <stoff-ident-origin nil="true"/> <stoff-ident-id nil="true"/> <susdat-id>NS00032331</susdat-id> <iupac>2-amino-3,5-dichloro-4-methylbenzenesulfonic 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>Benzenesulfonic acids and derivatives</subklass> <paper-count type="integer">0</paper-count> <sync-id>CED0083584</sync-id> <structure-inchikey>BUURMHBKUUZRFW-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>10000000000000000000000000000000000000000000000080000100000000000000000020002000000800000000000000000000000000000000000000000400000008000000020000020000000000000000000000000000000000000010000000800000000100000000000000000000000000000000010000000000040000000000000000000000000001000000000000000000000000000000000000000000000000000080000800000000000004000080000000000000000000000000000000000000000000000000010000000002000040000000000000000000008000000020040000000000000080000000000000000000000000000</structure-fingerprint> <structure-pattern-fingerprint>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</structure-pattern-fingerprint> <structure-pickle>ï¾­Þ������������������������€���`������@(������@(������� �����@(�������h�������@(������@h�������@(������� ������ ������`�������(�������(�����������h������h��� ��h���h���h�� �� � �� ��� ����h�B���������������������</structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T04:23:23Z</structure-indexed-at> </compound>