<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">85173</id>
  <title nil="true"/>
  <common-name>Diethyl 2-vinylcyclopropane-1,1-dicarboxylate</common-name>
  <description>Diethyl 2-vinylcyclopropane-1,1-dicarboxylate belongs to the cyclopropanecarboxylic acids and derivatives, a subclass of carboxylic acids and derivatives within the organic compounds. It has the chemical formula C11H16O4 and an average molecular weight of 212.25 g/mol. This compound is classified under the superclass of organic acids and derivatives.</description>
  <cas>7686-78-4</cas>
  <pubchem-id>111025</pubchem-id>
  <chemical-formula>C11H16O4</chemical-formula>
  <weight>212.24</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">2026-04-04T20:19:48Z</created-at>
  <updated-at type="dateTime">2026-08-18T11:50:29Z</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(CC1C=C)C(=O)OCC</moldb-smiles>
  <moldb-formula>C11H16O4</moldb-formula>
  <moldb-inchi>InChI=1/C11H16O4/c1-4-8-7-11(8,9(12)14-5-2)10(13)15-6-3/h4,8H,1,5-7H2,2-3H3</moldb-inchi>
  <moldb-inchikey>UOQTXZICFVMERR-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal">212.245</moldb-average-mass>
  <moldb-mono-mass type="decimal">212.104859</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>1.8</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>CHEM081066</chemdb-id>
  <dsstox-id>DTXSID90998169</dsstox-id>
  <toxcast-id nil="true"/>
  <stoff-ident-origin nil="true"/>
  <stoff-ident-id nil="true"/>
  <susdat-id>NS00045242</susdat-id>
  <iupac>diethyl 2-ethenylcyclopropane-1,1-dicarboxylate</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 acids and derivatives</superklass>
  <klass>Carboxylic acids and derivatives</klass>
  <subklass>Cyclopropanecarboxylic acids and derivatives</subklass>
  <paper-count type="integer">7</paper-count>
  <sync-id>CED0038998</sync-id>
  <structure-inchikey>UOQTXZICFVMERR-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>800000000000000010000000010000000000000000000000000002000000008000000000000100000000000000000000000004000010000000000000000000000000000000000020000001000300000000000000000000000000010020004000000000000000000000020008000000000000000000100000200048000000000200000000000000000000000000000000020000000000000000000000000000000200000000000000000000000000000000000000000000000000000000000000000000040000000000000000002000000000000000000000000000000000000000000000000400000000000000000000000000000000</structure-fingerprint>
  <structure-pattern-fingerprint>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</structure-pattern-fingerprint>
  <structure-pickle>ï¾­Þ������������������������€���`�������`�������(�������(�������(������� ������`�������`�������h��������h��������(�������(�������(�������`�������`�������������� ��(��������������	���
�
�(�
� �������B������������������</structure-pickle>
  <structure-indexed-at type="dateTime">2026-09-19T04:30:05Z</structure-indexed-at>
</compound>
