<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <version>1.0</version>
  <creation_date>2026-08-20 00:32:49 UTC</creation_date>
  <update_date>2026-08-20 00:32:49 UTC</update_date>
  <accession/>
  <common_name>3-phenylpropyl 2-(4-hydroxy-3-methoxyphenyl)acetate</common_name>
  <class>SmallMolecule</class>
  <description>3-phenylpropyl 2-(4-hydroxy-3-methoxyphenyl)acetate is an organic compound with the formula C18H20O4 and an average molecular weight of 300.30 g/mol. 3-phenylpropyl 2-(4-hydroxy-3-methoxyphenyl)acetate belongs to the methoxyphenols, a subclass of phenols within the organic compounds. It is further classified as a benzenoid. This compound has been identified in or released from two recorded sources, specifically household cleaning and consumer products including pipe accessories and tobacco product cases.</description>
  <categories/>
  <types/>
  <synonyms/>
  <chemical_formula>C18H20O4</chemical_formula>
  <average_molecular_weight>300.3</average_molecular_weight>
  <monisotopic_moleculate_weight>300.1361591</monisotopic_moleculate_weight>
  <iupac_name/>
  <traditional_iupac/>
  <cas_registry_number/>
  <smiles/>
  <inchi>InChI=1S/C18H20O4/c1-21-17-12-15(9-10-16(17)19)13-18(20)22-11-5-8-14-6-3-2-4-7-14/h2-4,6-7,9-10,12,19H,5,8,11,13H2,1H3</inchi>
  <inchikey>XCAJPVHAKFDCQH-UHFFFAOYSA-N</inchikey>
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    <sub_class/>
    <direct_parent/>
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  </taxonomy>
  <status>Detected and Not Quantified</status>
  <origin/>
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  <state/>
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  <experimental_properties>
    <property>
      <kind>logp</kind>
      <value>3.6</value>
    </property>
  </experimental_properties>
  <predicted_properties>
    <property>
      <kind>average_mass</kind>
      <value>300.3</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>mono_mass</kind>
      <value>300.1361591</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>formula</kind>
      <value>C18H20O4</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>inchi</kind>
      <value>InChI=1S/C18H20O4/c1-21-17-12-15(9-10-16(17)19)13-18(20)22-11-5-8-14-6-3-2-4-7-14/h2-4,6-7,9-10,12,19H,5,8,11,13H2,1H3</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>inchikey</kind>
      <value>XCAJPVHAKFDCQH-UHFFFAOYSA-N</value>
      <source>ChemAxon</source>
    </property>
  </predicted_properties>
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  <use_source/>
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  <symptoms/>
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  <drugbank_id/>
  <hmdb_id/>
  <pubchem_compound_id>118456505</pubchem_compound_id>
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