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<compound>
  <id type="integer">364128</id>
  <title nil="true"/>
  <common-name>Ethyl 2-[(6-chloropyrimidin-4-yl)amino]-2-oxoacetate</common-name>
  <description>Ethyl 2-[(6-chloropyrimidin-4-yl)amino]-2-oxoacetate is a chemical compound with the formula C8H8ClN3O3. It has an average molecular weight of 229.62 g/mol.</description>
  <cas>75274-21-4</cas>
  <pubchem-id>3058455</pubchem-id>
  <chemical-formula>C8H8ClN3O3</chemical-formula>
  <weight>229.62</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">2026-09-01T13:55:45Z</created-at>
  <updated-at type="dateTime">2026-09-01T13:55:45Z</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>CCOC(=O)C(=O)NC1=CC(=NC=N1)Cl</moldb-smiles>
  <moldb-formula>C8H8ClN3O3</moldb-formula>
  <moldb-inchi>InChI=1S/C8H8ClN3O3/c1-2-15-8(14)7(13)12-6-3-5(9)10-4-11-6/h3-4H,2H2,1H3,(H,10,11,12,13)</moldb-inchi>
  <moldb-inchikey>OZMPERPPSYTMBL-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">229.0254188</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>1.3</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>CHEM360021</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>Ethyl 2-[(6-chloropyrimidin-4-yl)amino]-2-oxoacetate</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>Organic acids and derivatives</superklass>
  <klass>Carboxylic acids and derivatives</klass>
  <subklass>Amino acids, peptides, and analogues</subklass>
  <paper-count type="integer" nil="true"/>
  <sync-id>CED0314141</sync-id>
  <structure-inchikey>OZMPERPPSYTMBL-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>100000800000000000000010000000000000000000000000000000000002000000004000000000002000000000000000000000000000404000000000000000500000000000000000000020000000004100000000000000000000000000010000000000000000100000000000000000000000000000000000000000000040000000001000000000000080000000000000200008020000040000000000000000000000000000080000000000000000080000000000000000000000000000000000000040000000000000000010000000002000000002000000400000208000000000000048000000000400000000000000000000000000000000</structure-fingerprint>
  <structure-pattern-fingerprint>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</structure-pattern-fingerprint>
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</structure-pickle>
  <structure-indexed-at type="dateTime">2026-09-19T06:00:33Z</structure-indexed-at>
</compound>
