<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">4740</id>
  <title>T3D4685</title>
  <common-name>Chloromethyl methyl ether</common-name>
  <description>Chloromethyl methyl ether is used to modify ion-exchange membranes used in the production of grapefruit juice

Chloromethyl methyl ether belongs to the family of Organochlorides. These are organic compounds containing a chlorine atom.</description>
  <cas>107-30-2</cas>
  <pubchem-id>7864</pubchem-id>
  <chemical-formula>C2H5ClO</chemical-formula>
  <weight>80.51</weight>
  <appearance></appearance>
  <melting-point>-103.5 °C</melting-point>
  <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></route-of-exposure>
  <target nil="true"/>
  <mechanism-of-toxicity></mechanism-of-toxicity>
  <metabolism></metabolism>
  <toxicity></toxicity>
  <lethaldose></lethaldose>
  <carcinogenicity>1, carcinogenic to humans. (L135)</carcinogenicity>
  <use-source></use-source>
  <min-risk-level></min-risk-level>
  <health-effects></health-effects>
  <symptoms></symptoms>
  <treatment></treatment>
  <created-at type="dateTime">2014-09-11T02:04:53Z</created-at>
  <updated-at type="dateTime">2026-04-16T21:11:54Z</updated-at>
  <interacting-proteins nil="true"/>
  <wikipedia></wikipedia>
  <uniprot-id></uniprot-id>
  <kegg-compound-id>C19160</kegg-compound-id>
  <omim-id></omim-id>
  <chebi-id nil="true"/>
  <biocyc-id nil="true"/>
  <ctd-id></ctd-id>
  <stitch-id></stitch-id>
  <drugbank-id nil="true"/>
  <pdb-id nil="true"/>
  <actor-id></actor-id>
  <organism nil="true"/>
  <export type="boolean">true</export>
  <metabolizing-proteins nil="true"/>
  <transporting-proteins nil="true"/>
  <moldb-smiles>COCCl</moldb-smiles>
  <moldb-formula>C2H5ClO</moldb-formula>
  <moldb-inchi>InChI=1S/C2H5ClO/c1-4-2-3/h2H2,1H3</moldb-inchi>
  <moldb-inchikey>XJUZRXYOEPSWMB-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal">80.514</moldb-average-mass>
  <moldb-mono-mass type="decimal">80.002892489</moldb-mono-mass>
  <origin>Exogenous</origin>
  <state>Liquid</state>
  <logp nil="true"/>
  <hmdb-id>HMDB31332</hmdb-id>
  <chembl-id></chembl-id>
  <chemspider-id>13852893</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>CHEM003643</chemdb-id>
  <dsstox-id>DTXSID6020307</dsstox-id>
  <toxcast-id nil="true"/>
  <stoff-ident-origin nil="true"/>
  <stoff-ident-id nil="true"/>
  <susdat-id>NS00020923</susdat-id>
  <iupac nil="true"/>
  <moldb-polar-surface-area>9.23</moldb-polar-surface-area>
  <moldb-refractivity>17.6519</moldb-refractivity>
  <moldb-polarizability>7.404739181110758</moldb-polarizability>
  <moldb-rotatable-bond-count>1</moldb-rotatable-bond-count>
  <moldb-acceptor-count>1</moldb-acceptor-count>
  <moldb-donor-count>0</moldb-donor-count>
  <moldb-pka-strongest-acidic nil="true"/>
  <moldb-pka-strongest-basic>-4.206815076988055</moldb-pka-strongest-basic>
  <moldb-physiological-charge>0</moldb-physiological-charge>
  <moldb-number-of-rings>0</moldb-number-of-rings>
  <moldb-alogps-logp>0.16</moldb-alogps-logp>
  <moldb-alogps-logs>0.22</moldb-alogps-logs>
  <moldb-alogps-solubility>1.34e+02 g/l</moldb-alogps-solubility>
</compound>
