<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">78738</id>
  <title nil="true"/>
  <common-name>2,2'-((2-Methyl-1-(1-methylethyl)propyl)imino)bisethanol</common-name>
  <description>2,2'-((2-Methyl-1-(1-methylethyl)propyl)imino)bisethanol belongs to the amines, a subclass of organonitrogen compounds within the organic compounds. This organic nitrogen compound has the chemical formula C11H25N1O2 and an average molecular weight of 203.33 g/mol.</description>
  <cas>71617-25-9</cas>
  <pubchem-id>44144677</pubchem-id>
  <chemical-formula>C11H25N1O2</chemical-formula>
  <weight nil="true"/>
  <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">2026-04-04T12:57:45Z</created-at>
  <updated-at type="dateTime">2026-04-04T12:57:45Z</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>CC(C)C(C(C)C)N(CCO)CCO</moldb-smiles>
  <moldb-formula>C11H25N1O2</moldb-formula>
  <moldb-inchi>InChI=1S/C11H25NO2/c1-9(2)11(10(3)4)12(5-7-13)6-8-14/h9-11,13-14H,5-8H2,1-4H3</moldb-inchi>
  <moldb-inchikey>LTRVNMADAVPVJC-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal">203.326</moldb-average-mass>
  <moldb-mono-mass type="decimal">203.188529</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp nil="true"/>
  <hmdb-id nil="true"/>
  <chembl-id nil="true"/>
  <chemspider-id>21168272</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>CHEM074631</chemdb-id>
  <dsstox-id>DTXSID30221862</dsstox-id>
  <toxcast-id nil="true"/>
  <stoff-ident-origin nil="true"/>
  <stoff-ident-id nil="true"/>
  <susdat-id>NS00037255</susdat-id>
  <iupac>2-[2,4-dimethylpentan-3-yl(2-hydroxyethyl)amino]ethanol</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 nitrogen compounds</superklass>
  <klass>Organonitrogen compounds</klass>
  <subklass>Amines</subklass>
  <paper-count type="integer">0</paper-count>
  <sync-id>CED0140379</sync-id>
  <structure-inchikey>LTRVNMADAVPVJC-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>40000008000000000000800000000000000000000000000000000002000000000000001000000000000000000000000000000000000000000000004000000000000000000000000000000000000000000000000000000000000000000000000004000000010000000000000000004000000000000000000000000400000040000000000040000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000200000000000000000000000000000000000000000000000000400080000000000000000000000000000000000020001000000000000000000000000</structure-fingerprint>
  <structure-pattern-fingerprint>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</structure-pattern-fingerprint>
  <structure-pickle>ï¾­Þ�����������������������€���`�������`�������`�������`�������`�������`�������`������� ������`�������`�������`�������`�������`�������`�������������������������������	�	
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  <structure-indexed-at type="dateTime">2026-09-19T04:26:08Z</structure-indexed-at>
</compound>
