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<compound>
  <version>1.0</version>
  <creation_date>2026-08-18 04:46:39 UTC</creation_date>
  <update_date>2026-08-18 04:46:39 UTC</update_date>
  <accession/>
  <common_name>(e)-2-cyano-3-(4-hydroxyphenyl)prop-2-enoic acid</common_name>
  <class>SmallMolecule</class>
  <description>(e)-2-cyano-3-(4-hydroxyphenyl)prop-2-enoic acid is an organic compound with the formula C10H7NO3 and an average molecular weight of 189.17 g/mol. (e)-2-cyano-3-(4-hydroxyphenyl)prop-2-enoic acid belongs to the hydroxycinnamic acids and derivatives, a subclass of cinnamic acids and derivatives within the organic compounds. It is further classified under the superclass of phenylpropanoids and polyketides.

This compound is found in or released from five recorded sources. These include electrical and electronic equipment, specifically auxiliary devices, emergency protective devices, and power cables. Additionally, it is associated with food, food processing and cookware, specifically in the preparation of malt and the preparation of wort.</description>
  <categories/>
  <types/>
  <synonyms/>
  <chemical_formula>C10H7NO3</chemical_formula>
  <average_molecular_weight>189.17</average_molecular_weight>
  <monisotopic_moleculate_weight>189.0425931</monisotopic_moleculate_weight>
  <iupac_name/>
  <traditional_iupac/>
  <cas_registry_number>122520-77-8</cas_registry_number>
  <smiles/>
  <inchi>InChI=1S/C10H7NO3/c11-6-8(10(13)14)5-7-1-3-9(12)4-2-7/h1-5,12H,(H,13,14)/b8-5+</inchi>
  <inchikey>AFVLVVWMAFSXCK-VMPITWQZSA-N</inchikey>
  <taxonomy>
    <kingdom/>
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    <class/>
    <sub_class/>
    <direct_parent/>
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    <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>1.4</value>
    </property>
  </experimental_properties>
  <predicted_properties>
    <property>
      <kind>average_mass</kind>
      <value>189.17</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>mono_mass</kind>
      <value>189.0425931</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>formula</kind>
      <value>C10H7NO3</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>inchi</kind>
      <value>InChI=1S/C10H7NO3/c11-6-8(10(13)14)5-7-1-3-9(12)4-2-7/h1-5,12H,(H,13,14)/b8-5+</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>inchikey</kind>
      <value>AFVLVVWMAFSXCK-VMPITWQZSA-N</value>
      <source>ChemAxon</source>
    </property>
  </predicted_properties>
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  <lethaldose/>
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  <use_source/>
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  <drugbank_id/>
  <hmdb_id/>
  <pubchem_compound_id>5328791</pubchem_compound_id>
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