<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <version>1.0</version>
  <creation_date>2026-04-06 13:14:14 UTC</creation_date>
  <update_date>2026-04-16 21:13:25 UTC</update_date>
  <accession/>
  <common_name>Benzene-D6</common_name>
  <class>SmallMolecule</class>
  <description>Benzene-D6 is an organic compound with the formula C6H6 and an average molecular weight of 84.15 g/mol. Benzene-D6 belongs to the benzene and substituted derivatives, a class of benzenoids within the organic compounds.

This substance is found in or released from seven recorded sources. Within the category of electrical and electronic equipment, it is associated with communication cables or conductors, loudspeakers, power cables, and superconductive or hyperconductive conductors cables or transmission lines. In the field of building and construction, it is linked to roofs, tents, or canopies. Additionally, it is found in food, food processing and cookware, specifically relating to fermentation processes for beer.</description>
  <categories/>
  <types/>
  <synonyms/>
  <chemical_formula>C6H6</chemical_formula>
  <average_molecular_weight/>
  <monisotopic_moleculate_weight>78.04695019</monisotopic_moleculate_weight>
  <iupac_name/>
  <traditional_iupac/>
  <cas_registry_number>1076-43-3</cas_registry_number>
  <smiles>C1=CC=CC=C1</smiles>
  <inchi>InChI=1S/C6H6/c1-2-4-6-5-3-1/h1-6H/i1D,2D,3D,4D,5D,6D</inchi>
  <inchikey>UHOVQNZJYSORNB-MZWXYZOWSA-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/>
  <predicted_properties>
    <property>
      <kind>mono_mass</kind>
      <value>78.04695019</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>smiles</kind>
      <value>C1=CC=CC=C1</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>formula</kind>
      <value>C6H6</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>inchi</kind>
      <value>InChI=1S/C6H6/c1-2-4-6-5-3-1/h1-6H/i1D,2D,3D,4D,5D,6D</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>inchikey</kind>
      <value>UHOVQNZJYSORNB-MZWXYZOWSA-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:0x00007f3bb3b2eee0&gt;</health_effects>
  <symptoms/>
  <treatment/>
  <drugbank_id/>
  <hmdb_id/>
  <pubchem_compound_id>71601</pubchem_compound_id>
  <chembl_id/>
  <chemspider_id/>
  <kegg_id/>
  <uniprot_id/>
  <omim_id/>
  <chebi_id/>
  <biocyc_id/>
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  <pdb_id/>
  <wikipidia/>
  <general_references/>
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