<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <version>1.0</version>
  <creation_date>2026-08-18 19:31:32 UTC</creation_date>
  <update_date>2026-08-18 19:31:32 UTC</update_date>
  <accession/>
  <common_name>2-chloro-n-ethyl-n-[(2-methylphenyl)methyl]ethanamine</common_name>
  <class>SmallMolecule</class>
  <description>2-chloro-n-ethyl-n-[(2-methylphenyl)methyl]ethanamine is an organic compound with the formula C12H18ClN and an average molecular weight of 211.73 g/mol. 2-chloro-n-ethyl-n-[(2-methylphenyl)methyl]ethanamine belongs to the phenylmethylamines, a subclass of benzene and substituted derivatives within the organic compounds.

This compound is found in or released from five recorded sources. These include soap detergents used in household cleaning and consumer products, as well as the preparation of wort within food, food processing and cookware. Additionally, it is associated with electrical and electronic equipment, specifically conductors or conductive bodies characterised by the conductive materials, electrodes, and fixed capacitors and their manufacture.</description>
  <categories/>
  <types/>
  <synonyms/>
  <chemical_formula>C12H18ClN</chemical_formula>
  <average_molecular_weight>211.73</average_molecular_weight>
  <monisotopic_moleculate_weight>211.1127773</monisotopic_moleculate_weight>
  <iupac_name/>
  <traditional_iupac/>
  <cas_registry_number>78686-02-9</cas_registry_number>
  <smiles/>
  <inchi>InChI=1S/C12H18ClN/c1-3-14(9-8-13)10-12-7-5-4-6-11(12)2/h4-7H,3,8-10H2,1-2H3</inchi>
  <inchikey>XHRCFGDFESIFRG-UHFFFAOYSA-N</inchikey>
  <taxonomy>
    <kingdom/>
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    <class/>
    <sub_class/>
    <direct_parent/>
    <alternate_parents/>
    <substituents/>
    <molecular_framework/>
    <descriptors/>
  </taxonomy>
  <status>Detected and Not Quantified</status>
  <origin/>
  <cellular_locations/>
  <biofluid_locations/>
  <tissue_locations/>
  <pathways/>
  <state/>
  <appearance/>
  <experimental_properties>
    <property>
      <kind>logp</kind>
      <value>3.1</value>
    </property>
  </experimental_properties>
  <predicted_properties>
    <property>
      <kind>average_mass</kind>
      <value>211.73</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>mono_mass</kind>
      <value>211.1127773</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>formula</kind>
      <value>C12H18ClN</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>inchi</kind>
      <value>InChI=1S/C12H18ClN/c1-3-14(9-8-13)10-12-7-5-4-6-11(12)2/h4-7H,3,8-10H2,1-2H3</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>inchikey</kind>
      <value>XHRCFGDFESIFRG-UHFFFAOYSA-N</value>
      <source>ChemAxon</source>
    </property>
  </predicted_properties>
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  <use_source/>
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  <pubchem_compound_id>5706</pubchem_compound_id>
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