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<compound>
  <id type="integer">63122</id>
  <title nil="true"/>
  <common-name>Imidacloprid olefin</common-name>
  <description>Imidacloprid olefin is an organic compound with the formula C9H8Cl1N5O2 and an average molecular weight of 253.65 g/mol. Imidacloprid olefin belongs to the halopyridines, a subclass of pyridines and derivatives within the organic compounds. It is categorized under the superclass of organoheterocyclic compounds. This substance is found in or released from one recorded source: agriculture and land management pesticides. Recorded exposure routes for this compound include inhalation, oral, and touch.</description>
  <cas>1115248-04-8</cas>
  <pubchem-id>14626249</pubchem-id>
  <chemical-formula>C9H8Cl1N5O2</chemical-formula>
  <weight>253.64</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">2026-04-02T23:13:04Z</created-at>
  <updated-at type="dateTime">2026-08-25T21:03:09Z</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>[O-][N+](=O)NC1=NC=CN1CC1=CC=C(Cl)N=C1</moldb-smiles>
  <moldb-formula>C9H8Cl1N5O2</moldb-formula>
  <moldb-inchi>InChI=1S/C9H8ClN5O2/c10-8-2-1-7(5-12-8)6-14-4-3-11-9(14)13-15(16)17/h1-5H,6H2,(H,11,13)</moldb-inchi>
  <moldb-inchikey>TYLCDJYHUVCRBH-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal">253.65</moldb-average-mass>
  <moldb-mono-mass type="decimal">253.036652</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>2</logp>
  <hmdb-id nil="true"/>
  <chembl-id nil="true"/>
  <chemspider-id>10248199</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>CHEM059015</chemdb-id>
  <dsstox-id>DTXSID6037562</dsstox-id>
  <toxcast-id nil="true"/>
  <stoff-ident-origin nil="true"/>
  <stoff-ident-id nil="true"/>
  <susdat-id>NS00014262</susdat-id>
  <iupac>N-[1-[(6-chloropyridin-3-yl)methyl]imidazol-2-yl]nitramide</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>Organoheterocyclic compounds</superklass>
  <klass>Pyridines and derivatives</klass>
  <subklass>Halopyridines</subklass>
  <paper-count type="integer">333</paper-count>
  <sync-id>CED0012823</sync-id>
  <structure-inchikey>TYLCDJYHUVCRBH-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>800000000000000000040000000000000000000000000000000000200200000000001000002010000000000000000000000000000000000000000000400000000000000000000020000000000000101000000000400000000000000004000200000000000400004080000100000000000000000010000000000000000000000400000000000080000000000000000000000000800000000800000000000000000000080008000000000000090000010000200000000100000000000000000000000000000000000010000000000000000222044000000000000000000000002040000000000000000000001000000000000000000000</structure-fingerprint>
  <structure-pattern-fingerprint>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</structure-pattern-fingerprint>
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</structure-pickle>
  <structure-indexed-at type="dateTime">2026-09-19T04:16:04Z</structure-indexed-at>
</compound>
