<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">365258</id>
  <title nil="true"/>
  <common-name>2-[4-[(2-methylpropan-2-yl)oxycarbamoyl]triazol-1-yl]acetic acid</common-name>
  <description>2-[4-[(2-methylpropan-2-yl)oxycarbamoyl]triazol-1-yl]acetic acid is a compound with the formula C9H14N4O4. It has an average molecular weight of 242.23 g/mol.</description>
  <cas>2624140-27-6</cas>
  <pubchem-id>155978178</pubchem-id>
  <chemical-formula>C9H14N4O4</chemical-formula>
  <weight>242.23</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">2026-09-01T15:45:42Z</created-at>
  <updated-at type="dateTime">2026-09-01T15:45:42Z</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)ONC(=O)C1=CN(N=N1)CC(=O)O</moldb-smiles>
  <moldb-formula>C9H14N4O4</moldb-formula>
  <moldb-inchi>InChI=1S/C9H14N4O4/c1-9(2,3)17-11-8(16)6-4-13(12-10-6)5-7(14)15/h4H,5H2,1-3H3,(H,11,16)(H,14,15)</moldb-inchi>
  <moldb-inchikey>RYAAZXWXCBGKIQ-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">242.1015049</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>0</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>CHEM361151</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>2-[4-[(2-methylpropan-2-yl)oxycarbamoyl]triazol-1-yl]acetic 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 nil="true"/>
  <superklass nil="true"/>
  <klass nil="true"/>
  <subklass nil="true"/>
  <paper-count type="integer" nil="true"/>
  <sync-id>CED0315214</sync-id>
  <structure-inchikey>RYAAZXWXCBGKIQ-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>800000002000000000000000000000040000000000000000000000001000000000000000002004800000000000000000800002000000000000000000000000000000000000002020000000000100000200000010000000040000010000000000010000000000000000000100000000000000000000000000000050000000000000000000000080081002000000000000000000000000000000008000000000000000080000000020000000000000000010000000000000000000000000000000000008000000000000000000000000400000400001000000000000000000100040000000000400000001000000000000000000000000</structure-fingerprint>
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</structure-pickle>
  <structure-indexed-at type="dateTime">2026-09-19T06:01:23Z</structure-indexed-at>
</compound>
