<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">365215</id>
  <title nil="true"/>
  <common-name>4-amino-n-(2-hydroxyethyl)-2-methylbenzenesulfonamide</common-name>
  <description>4-amino-n-(2-hydroxyethyl)-2-methylbenzenesulfonamide is a chemical compound with the formula C9H14N2O3S. It has an average molecular weight of 230.29 g/mol.</description>
  <cas>69226-39-7</cas>
  <pubchem-id>3052695</pubchem-id>
  <chemical-formula>C9H14N2O3S</chemical-formula>
  <weight>230.29</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">2026-09-01T15:42:27Z</created-at>
  <updated-at type="dateTime">2026-09-01T15:42:27Z</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(C=CC(=C1)N)S(=O)(=O)NCCO</moldb-smiles>
  <moldb-formula>C9H14N2O3S</moldb-formula>
  <moldb-inchi>InChI=1S/C9H14N2O3S/c1-7-6-8(10)2-3-9(7)15(13,14)11-4-5-12/h2-3,6,11-12H,4-5,10H2,1H3</moldb-inchi>
  <moldb-inchikey>XZKDKBLWOVZGFR-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">230.0725135</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>-0.1</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>CHEM361108</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-amino-n-(2-hydroxyethyl)-2-methylbenzenesulfonamide</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>Benzenesulfonamides</subklass>
  <paper-count type="integer" nil="true"/>
  <sync-id>CED0315172</sync-id>
  <structure-inchikey>XZKDKBLWOVZGFR-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>800000000000000000000000000000000202200000000000000000000000000000020000000000800000000000000000004000000200000000000000000000000000000000008120001000000000000010080000000000000000010000000000000000100080000000000000000000000000000000000000000040000000000000000000000082009000004000000000000000000000000000000000000000000000080100000000000000004000080000000000000000000000000000000000002000000000000000000000002000000200000000000000000000000000002040000000000000000000000000000000000000000000</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�B���������������������</structure-pickle>
  <structure-indexed-at type="dateTime">2026-09-19T06:01:21Z</structure-indexed-at>
</compound>
