<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <version>1.0</version>
  <creation_date>2026-08-25 11:04:09 UTC</creation_date>
  <update_date>2026-08-25 11:04:09 UTC</update_date>
  <accession/>
  <common_name>2-hydroperoxypropan-2-ylbenzene</common_name>
  <class>SmallMolecule</class>
  <description>2-hydroperoxypropan-2-ylbenzene is an organic compound with the formula C9H12O2 and an average molecular weight of 152.19 g/mol. 2-hydroperoxypropan-2-ylbenzene belongs to the phenylpropanes, a subclass of benzene and substituted derivatives within the organic compounds.

This compound is found in or released from 31 recorded sources. Within the category of electrical and electronic equipment, it is associated with antennas, coils, communication cables or conductors, adjustable resistors, and conductors or conductive bodies characterised by the conductive materials, among 14 other sources. It is also identified in household cleaning and consumer products, specifically within soap detergents, bleaching agents, perfumes within detergents and soaps, cigar cigarettes, and tobacco smoke filters. In the context of food, food processing, and cookware, the compound is linked to food preservation, the processing of meats, the processing of fish, and fermentation processes for beer. Additionally, it is found in building and construction materials, including fencing and sunshades awnings or outside screens.</description>
  <categories/>
  <types/>
  <synonyms/>
  <chemical_formula>C9H12O2</chemical_formula>
  <average_molecular_weight>152.19</average_molecular_weight>
  <monisotopic_moleculate_weight>152.0837296</monisotopic_moleculate_weight>
  <iupac_name/>
  <traditional_iupac/>
  <cas_registry_number>80-15-9</cas_registry_number>
  <smiles/>
  <inchi>InChI=1S/C9H12O2/c1-9(2,11-10)8-6-4-3-5-7-8/h3-7,10H,1-2H3</inchi>
  <inchikey>YQHLDYVWEZKEOX-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>
    <pathway>
      <name>Mycobacterium tuberculosis pathway</name>
      <smpdb_id>SMP0713862</smpdb_id>
      <kegg_map_id/>
    </pathway>
    <pathway>
      <name>Isoniazid Action Pathway</name>
      <smpdb_id>SMP0718080</smpdb_id>
      <kegg_map_id/>
    </pathway>
    <pathway>
      <name>Rifampicin Action Pathway</name>
      <smpdb_id>SMP0718081</smpdb_id>
      <kegg_map_id/>
    </pathway>
    <pathway>
      <name>Pyrazinamide Action Pathway</name>
      <smpdb_id>SMP0718082</smpdb_id>
      <kegg_map_id/>
    </pathway>
    <pathway>
      <name>Ethambutol Action Pathway</name>
      <smpdb_id>SMP0718083</smpdb_id>
      <kegg_map_id/>
    </pathway>
    <pathway>
      <name>Streptomycin Tuberculosis Action Pathway</name>
      <smpdb_id>SMP0718084</smpdb_id>
      <kegg_map_id/>
    </pathway>
  </pathways>
  <state/>
  <appearance/>
  <experimental_properties>
    <property>
      <kind>logp</kind>
      <value>1.7</value>
    </property>
  </experimental_properties>
  <predicted_properties>
    <property>
      <kind>average_mass</kind>
      <value>152.19</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>mono_mass</kind>
      <value>152.0837296</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>formula</kind>
      <value>C9H12O2</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>inchi</kind>
      <value>InChI=1S/C9H12O2/c1-9(2,11-10)8-6-4-3-5-7-8/h3-7,10H,1-2H3</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>inchikey</kind>
      <value>YQHLDYVWEZKEOX-UHFFFAOYSA-N</value>
      <source>ChemAxon</source>
    </property>
  </predicted_properties>
  <route_of_exposure/>
  <mechanism_of_toxicity/>
  <metabolism/>
  <toxicity/>
  <lethaldose/>
  <carcinogenicity/>
  <use_source/>
  <min_risk_level/>
  <health_effects>#&lt;HealthEffect::ActiveRecord_Associations_CollectionProxy:0x00007f721f76ea60&gt;</health_effects>
  <symptoms/>
  <treatment/>
  <drugbank_id/>
  <hmdb_id/>
  <pubchem_compound_id>6629</pubchem_compound_id>
  <chembl_id/>
  <chemspider_id/>
  <kegg_id/>
  <uniprot_id/>
  <omim_id/>
  <chebi_id/>
  <biocyc_id/>
  <ctd_id/>
  <stitch_id/>
  <actor_id/>
  <pdb_id/>
  <wikipidia/>
  <general_references/>
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</compound>
