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<compound>
  <id type="integer">22178</id>
  <title nil="true"/>
  <common-name>Hydroxymethylglycinate</common-name>
  <description>Hydroxymethylglycinate is an organic compound with the chemical formula C3H7NO3 and an average molecular weight of 105.09 g/mol. Hydroxymethylglycinate belongs to the amino acids, peptides, and analogues, a subclass of carboxylic acids and derivatives within the organic compounds. In industrial applications, the compound serves several roles, functioning as a preservative, a biocide, and a softener and conditioner.</description>
  <cas>70161-44-3</cas>
  <pubchem-id>23664641</pubchem-id>
  <chemical-formula>C3H7NO3</chemical-formula>
  <weight>127.07</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">2016-05-25T02:54:51Z</created-at>
  <updated-at type="dateTime">2026-08-22T13:42:28Z</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>OCNCC(O)=O</moldb-smiles>
  <moldb-formula>C3H7NO3</moldb-formula>
  <moldb-inchi>InChI=1S/C3H7NO3/c5-2-4-1-3(6)7/h4-5H,1-2H2,(H,6,7)</moldb-inchi>
  <moldb-inchikey>WBTIFBJEYFLFFW-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal">105.093</moldb-average-mass>
  <moldb-mono-mass type="decimal">105.042593089</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>-3.7</logp>
  <hmdb-id nil="true"/>
  <chembl-id nil="true"/>
  <chemspider-id>8466272</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>CHEM021073</chemdb-id>
  <dsstox-id>DTXSID5035799</dsstox-id>
  <toxcast-id nil="true"/>
  <stoff-ident-origin nil="true"/>
  <stoff-ident-id nil="true"/>
  <susdat-id>NS00019396</susdat-id>
  <iupac>2-(hydroxymethylamino)acetic acid</iupac>
  <moldb-polar-surface-area>69.56</moldb-polar-surface-area>
  <moldb-refractivity>21.8798</moldb-refractivity>
  <moldb-polarizability>9.597544773119827</moldb-polarizability>
  <moldb-rotatable-bond-count>3</moldb-rotatable-bond-count>
  <moldb-acceptor-count>4</moldb-acceptor-count>
  <moldb-donor-count>3</moldb-donor-count>
  <moldb-pka-strongest-acidic>2.546054617845652</moldb-pka-strongest-acidic>
  <moldb-pka-strongest-basic>8.411113237830586</moldb-pka-strongest-basic>
  <moldb-physiological-charge>0</moldb-physiological-charge>
  <moldb-number-of-rings>0</moldb-number-of-rings>
  <moldb-alogps-logp>-3.24</moldb-alogps-logp>
  <moldb-alogps-logs>0.19</moldb-alogps-logs>
  <moldb-alogps-solubility>1.62e+02 g/l</moldb-alogps-solubility>
  <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">15</paper-count>
  <sync-id>CED0023837</sync-id>
  <structure-inchikey>WBTIFBJEYFLFFW-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>8100000000000800000000000000000000000000000000002000000000000000000000000000000000000000006000000000000000000000000000000000000000000000000000000000000000020000000000000000000000000000000000000010000000000000000000000000000000000000000000000000800000000000000000000000000000000000080000000000000000000000000000000010000000000000000000000000000000000000080000000000000000000000000000000000000000000000000000000000000000000000000400000000000000000000000000000000000000000000400000000000000000000000000000000</structure-fingerprint>
  <structure-pattern-fingerprint>60000000000000000000000000000040000000000400000000000000040000000000000000000000000042000800004000000004400000000000011000000000000000000200042010000000000000000020000000000000900002000000000000000000000502000002000001001046000111800000010000200440080040000000000000088000000100400024440000000040800000000000043000000000000000008000000000002c0000000000000000000000000000000000000044000000000000000000000000000000000400000000000080000000000000000000000000000000000000000000010004000000000000050400002</structure-pattern-fingerprint>
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</structure-pickle>
  <structure-indexed-at type="dateTime">2026-09-19T04:08:47Z</structure-indexed-at>
</compound>
