<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">67331</id>
  <title nil="true"/>
  <common-name>O-2-Naphthyl chlorothioformate</common-name>
  <description>O-2-Naphthyl chlorothioformate belongs to the naphthalenes, a class of benzenoids within the organic compounds. This compound has the formula C11H7Cl1O1S1 and an average molecular weight of 222.69 g/mol.</description>
  <cas>10506-37-3</cas>
  <pubchem-id>82681</pubchem-id>
  <chemical-formula>C11H7Cl1O1S1</chemical-formula>
  <weight>222.69</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">2026-04-03T09:18:33Z</created-at>
  <updated-at type="dateTime">2026-08-18T14:24:56Z</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>ClC(=S)OC1=CC2=CC=CC=C2C=C1</moldb-smiles>
  <moldb-formula>C11H7Cl1O1S1</moldb-formula>
  <moldb-inchi>InChI=1S/C11H7ClOS/c12-11(14)13-10-6-5-8-3-1-2-4-9(8)7-10/h1-7H</moldb-inchi>
  <moldb-inchikey>INFPIPCTRVDPJG-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal">222.69</moldb-average-mass>
  <moldb-mono-mass type="decimal">221.990613</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>4.9</logp>
  <hmdb-id nil="true"/>
  <chembl-id nil="true"/>
  <chemspider-id>74614</chemspider-id>
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  <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>CHEM063224</chemdb-id>
  <dsstox-id>DTXSID20146934</dsstox-id>
  <toxcast-id nil="true"/>
  <stoff-ident-origin nil="true"/>
  <stoff-ident-id nil="true"/>
  <susdat-id>NS00021470</susdat-id>
  <iupac>O-naphthalen-2-yl chloromethanethioate</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>Naphthalenes</klass>
  <subklass nil="true"/>
  <paper-count type="integer">0</paper-count>
  <sync-id>CED0072732</sync-id>
  <structure-inchikey>INFPIPCTRVDPJG-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>40020000000000000000000000100000000000000000000000000000200000000000000000000000000000000000000000000000000000000010000000000200800000000000000000000100000200000000000000000000010000001000000000100000000000000000000000000000000000001000000000000001800000000000000000000000000100000000000000000000000800000000000000000000080000000000000000000000000000000000000000000000000000000000000000000000000010000000000040000200000000100000000000000001000040000000000000000000000000000000000000000000</structure-fingerprint>
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  <structure-indexed-at type="dateTime">2026-09-19T04:17:37Z</structure-indexed-at>
</compound>
