<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <version>1.0</version>
  <creation_date>2026-08-25 04:36:32 UTC</creation_date>
  <update_date>2026-08-25 04:36:32 UTC</update_date>
  <accession/>
  <common_name>1-bromo-2-ethoxybenzene</common_name>
  <class>SmallMolecule</class>
  <description>1-bromo-2-ethoxybenzene belongs to the phenol ethers, a class of benzenoids within the organic compounds. It has the chemical formula C8H9BrO and an average molecular weight of 201.06 g/mol.</description>
  <categories/>
  <types/>
  <synonyms/>
  <chemical_formula>C8H9BrO</chemical_formula>
  <average_molecular_weight>201.06</average_molecular_weight>
  <monisotopic_moleculate_weight>199.98368</monisotopic_moleculate_weight>
  <iupac_name/>
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  <cas_registry_number>583-19-7</cas_registry_number>
  <smiles/>
  <inchi>InChI=1S/C8H9BrO/c1-2-10-8-6-4-3-5-7(8)9/h3-6H,2H2,1H3</inchi>
  <inchikey>JVEQWIQHHWNMQX-UHFFFAOYSA-N</inchikey>
  <taxonomy>
    <kingdom/>
    <super_class/>
    <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>3.2</value>
    </property>
  </experimental_properties>
  <predicted_properties>
    <property>
      <kind>average_mass</kind>
      <value>201.06</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>mono_mass</kind>
      <value>199.98368</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>formula</kind>
      <value>C8H9BrO</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>inchi</kind>
      <value>InChI=1S/C8H9BrO/c1-2-10-8-6-4-3-5-7(8)9/h3-6H,2H2,1H3</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>inchikey</kind>
      <value>JVEQWIQHHWNMQX-UHFFFAOYSA-N</value>
      <source>ChemAxon</source>
    </property>
  </predicted_properties>
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  <use_source/>
  <min_risk_level/>
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  <symptoms/>
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  <drugbank_id/>
  <hmdb_id/>
  <pubchem_compound_id>68500</pubchem_compound_id>
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