<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">4588</id>
  <title>T3D4534</title>
  <common-name>Quintozene</common-name>
  <description>Quintozene, also known as pentachloronitrobenzene, is a registered fungicide formally derived from nitrobenzene used as soil fungicide on lawns and ornamental crops, as a seed treatment of field crops and vegetables (e.g., barley, corn, cotton, oats, rice, and wheat), and as a slime inhibitor in industrial waters. It is also used to prevent the formation of slime in industrial waters. It is either an off-white or yellow solid, depending on its purity, with a musty odor. Residual amounts of the compound and its metabolites can be found in crops. The degradation products, PCA and PCTA have been found in farming soils and in river sediments. Its mode of action is through contact and interferes with mitotic division.</description>
  <cas>82-68-8</cas>
  <pubchem-id>6720</pubchem-id>
  <chemical-formula>C6Cl5NO2</chemical-formula>
  <weight nil="true"/>
  <appearance>White powder.</appearance>
  <melting-point>44°C</melting-point>
  <boiling-point>328°C</boiling-point>
  <density nil="true"/>
  <solubility></solubility>
  <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>3, not classifiable as to its carcinogenicity to humans. (L135)</carcinogenicity>
  <use-source>This is a man-made compound that is used as a pesticide.</use-source>
  <min-risk-level nil="true"/>
  <health-effects nil="true"/>
  <symptoms nil="true"/>
  <treatment nil="true"/>
  <created-at type="dateTime">2014-08-29T06:51:45Z</created-at>
  <updated-at type="dateTime">2014-12-24T20:26:52Z</updated-at>
  <interacting-proteins nil="true"/>
  <wikipedia nil="true"/>
  <uniprot-id nil="true"/>
  <kegg-compound-id>C14338</kegg-compound-id>
  <omim-id nil="true"/>
  <chebi-id>CHEBI:34908</chebi-id>
  <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>ClC1=C(Cl)C(Cl)=C(C(Cl)=C1Cl)N(=O)=O</moldb-smiles>
  <moldb-formula>C6Cl5NO2</moldb-formula>
  <moldb-inchi>InChI=1S/C6Cl5NO2/c7-1-2(8)4(10)6(12(13)14)5(11)3(1)9</moldb-inchi>
  <moldb-inchikey>InChIKey=LKPLKUMXSAEKID-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal">295.335</moldb-average-mass>
  <moldb-mono-mass type="decimal">292.837166784</moldb-mono-mass>
  <origin>Exogenous</origin>
  <state>Solid</state>
  <logp nil="true"/>
  <hmdb-id nil="true"/>
  <chembl-id>CHEMBL468759</chembl-id>
  <chemspider-id>6464</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></synthesis-reference>
  <structure-image-caption nil="true"/>
</compound>
