<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">360440</id>
  <title nil="true"/>
  <common-name>Propyl n-(2,2-dichloroethyl)carbamate</common-name>
  <description>Propyl n-(2,2-dichloroethyl)carbamate is a chemical compound with the formula C6H11Cl2NO2. It has an average molecular weight of 200.06 g/mol.</description>
  <cas>67049-77-8</cas>
  <pubchem-id>49100</pubchem-id>
  <chemical-formula>C6H11Cl2NO2</chemical-formula>
  <weight>200.06</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">2026-09-01T08:53:51Z</created-at>
  <updated-at type="dateTime">2026-09-01T08:53:51Z</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>CCCOC(=O)NCC(Cl)Cl</moldb-smiles>
  <moldb-formula>C6H11Cl2NO2</moldb-formula>
  <moldb-inchi>InChI=1S/C6H11Cl2NO2/c1-2-3-11-6(10)9-4-5(7)8/h5H,2-4H2,1H3,(H,9,10)</moldb-inchi>
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  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">199.016684</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>2.2</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>CHEM356333</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>Propyl n-(2,2-dichloroethyl)carbamate</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>Amino acids, peptides, and analogues</subklass>
  <paper-count type="integer" nil="true"/>
  <sync-id>CED0310613</sync-id>
  <structure-inchikey>PZIDPLPCKTWJOD-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>40040000000000000000800000000000000010000100000004000000008000000000000002000000000000000000000000000000000000000000000000800000000000000000000000000002000000000020000000000100000002000000000000000020010000000000000002000000000020000000000000000000000000000000000040000080000000000000000080000000000000000000000000000000000000000000000000000000000000000000000000000000002000000000000000000000000000000000000000000000000010000000000000000002000000000000000000000000000000000000000400000000000000000000000008000000</structure-fingerprint>
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  <structure-indexed-at type="dateTime">2026-09-19T05:57:54Z</structure-indexed-at>
</compound>
