<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">303360</id>
  <title nil="true"/>
  <common-name>2-(diethylamino)ethyl 1-phenylcyclopropane-1-carboxylate</common-name>
  <description>2-(diethylamino)ethyl 1-phenylcyclopropane-1-carboxylate belongs to the benzene and substituted derivatives, a class of benzenoids within the organic compounds. This compound has the chemical formula C16H23NO2 and an average molecular weight of 261.36 g/mol.</description>
  <cas nil="true"/>
  <pubchem-id>49712</pubchem-id>
  <chemical-formula>C16H23NO2</chemical-formula>
  <weight>261.36</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">2026-08-28T20:36:50Z</created-at>
  <updated-at type="dateTime">2026-08-28T20:36:50Z</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>CCN(CC)CCOC(=O)C1(CC1)C2=CC=CC=C2</moldb-smiles>
  <moldb-formula>C16H23NO2</moldb-formula>
  <moldb-inchi>InChI=1S/C16H23NO2/c1-3-17(4-2)12-13-19-15(18)16(10-11-16)14-8-6-5-7-9-14/h5-9H,3-4,10-13H2,1-2H3</moldb-inchi>
  <moldb-inchikey>TVKWWWWNRZRAFI-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">261.172879</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>2.8</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>CHEM299253</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-(diethylamino)ethyl 1-phenylcyclopropane-1-carboxylate</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 nil="true"/>
  <paper-count type="integer" nil="true"/>
  <sync-id>CED0254553</sync-id>
  <structure-inchikey>TVKWWWWNRZRAFI-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>4010000000000000080000000000000001000000000000000000000000010000000000a000000000000000000000004000100000000000000000000000000000000000008000000000000000800000020000000000100000000000000000008000000010000004000000000004000000000020800000800000000000000000000000048000002800000000000000000200000000900000000000000000000000000000000000000000000080000000000000000000008000000000000000000000000000000000000000000000000080000000000000000000200000000000000000000000000000040000000000400000001000000040000000000000000</structure-fingerprint>
  <structure-pattern-fingerprint>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</structure-pattern-fingerprint>
  <structure-pickle>ï¾­Þ������������������������€���`�������`������� ������`�������`�������`�������`�������(�������(�������(������� ������`�������`������@(������@h�������@h�������@h�������@h�������@h������������������������������ �	(��
�
�����
��h���h���h���h���h��
��h�B������
�����������������</structure-pickle>
  <structure-indexed-at type="dateTime">2026-09-19T05:12:43Z</structure-indexed-at>
</compound>
