<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">319813</id>
  <title nil="true"/>
  <common-name>Ethyl 2-[2-[2-(dimethylamino)ethoxy]-2-oxoethoxy]-6-methyl-3-propan-2-ylbenzoate</common-name>
  <description>Ethyl 2-[2-[2-(dimethylamino)ethoxy]-2-oxoethoxy]-6-methyl-3-propan-2-ylbenzoate is a chemical compound with the formula C19H29NO5. It has an average molecular weight of 351.40 g/mol.</description>
  <cas>52073-13-9</cas>
  <pubchem-id>40208</pubchem-id>
  <chemical-formula>C19H29NO5</chemical-formula>
  <weight>351.4</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">2026-08-29T18:31:31Z</created-at>
  <updated-at type="dateTime">2026-08-29T18:31:31Z</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)C1=C(C=CC(=C1OCC(=O)OCCN(C)C)C(C)C)C</moldb-smiles>
  <moldb-formula>C19H29NO5</moldb-formula>
  <moldb-inchi>InChI=1S/C19H29NO5/c1-7-23-19(22)17-14(4)8-9-15(13(2)3)18(17)25-12-16(21)24-11-10-20(5)6/h8-9,13H,7,10-12H2,1-6H3</moldb-inchi>
  <moldb-inchikey>LXACVVADKCRIQI-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">351.204573</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>3.6</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>CHEM315706</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-[2-[2-(dimethylamino)ethoxy]-2-oxoethoxy]-6-methyl-3-propan-2-ylbenzoate</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>Phenoxyacetic acid derivatives</subklass>
  <paper-count type="integer" nil="true"/>
  <sync-id>CED0270579</sync-id>
  <structure-inchikey>LXACVVADKCRIQI-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>40040000000002000000800000000040000050000000000000000000000400000000001002000000000400000000000000000000000000000000000000000000000000000000000000200200000000001028000000000500000000000000010000000000250000000000000000004000000000000000000000000000000000000020000040000000000000000000000000100000000000000000020000000000000020080000000000000000082100000000001000080000000000000000000000000000000000000000000000000000080000100000002020000200000008000000000000000000000040000000000400000001000000000008080000000000</structure-fingerprint>
  <structure-pattern-fingerprint>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</structure-pattern-fingerprint>
  <structure-pickle>ï¾­Þ������������������������€���`�������`�������(�������(�������(������@(������@(������@h�������@h�������@(������@(�������(�������`�������(�������(�������(�������`�������`������� ������`�������`�������`�������`�������`�������`�������������� ��(��� ��h���h���h��	h�	
h�
� ������(�� ���������������	�����������
�h�B������
	�������������</structure-pickle>
  <structure-indexed-at type="dateTime">2026-09-19T05:25:06Z</structure-indexed-at>
</compound>
