<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <version>1.0</version>
  <creation_date>2016-05-19 03:00:02 UTC</creation_date>
  <update_date>2026-08-22 09:34:29 UTC</update_date>
  <accession/>
  <common_name>Glyoxal</common_name>
  <class>SmallMolecule</class>
  <description>Glyoxal is an organic oxygen compound with the chemical formula C2H2O2 and an average molecular weight of 58.04 g/mol. Glyoxal belongs to the carbonyl compounds, a subclass of organooxygen compounds within the organic compounds.

Industrially, this compound serves several roles and uses, functioning as a biocide, fragrance, film former, and chemical reaction regulator. In the production of plastics, it is used in Polyamide and Polyethylene Terephthalate. Glyoxal is found in or released from 34 recorded sources. Within the category of household cleaning and consumer products, it is associated with bleaching agents, perfumes within detergents and soaps, cigar cigarettes, non electric simulated smoking devices, and other smoking requisites. In food, food processing and cookware, it is linked to food contact materials, food preservation, the preparation of malt, the preparation of vinegar, and fermentation processes for beer. Its presence in building and construction is recorded in ceilings. Additionally, it is found in electrical and electronic equipment, including antennas, auxiliary devices, communication cables or conductors, conductors or conductive bodies characterised by the conductive materials, and cores yokes or armatures. Recorded exposure routes for the compound include touch, oral, and inhalation.</description>
  <categories/>
  <types/>
  <synonyms>
    <synonym>Amines, polyethylenepoly-, benzyl chloride-quaternized, polymers with glyoxal</synonym>
    <synonym>Vinyl acetal polymers, butyrals</synonym>
  </synonyms>
  <chemical_formula>C2H2O2</chemical_formula>
  <average_molecular_weight>58.0361</average_molecular_weight>
  <monisotopic_moleculate_weight>58.005479308</monisotopic_moleculate_weight>
  <iupac_name>oxaldehyde</iupac_name>
  <traditional_iupac>glyoxal</traditional_iupac>
  <cas_registry_number>107-22-2</cas_registry_number>
  <smiles>O=CC=O</smiles>
  <inchi>InChI=1S/C2H2O2/c3-1-2-4/h1-2H</inchi>
  <inchikey>LEQAOMBKQFMDFZ-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>-0.4</value>
    </property>
  </experimental_properties>
  <predicted_properties>
    <property>
      <kind>logp</kind>
      <value>-0.04</value>
      <source>ALOGPS</source>
    </property>
    <property>
      <kind>logs</kind>
      <value>0.57</value>
      <source>ALOGPS</source>
    </property>
    <property>
      <kind>solubility</kind>
      <value>2.18e+02 g/l</value>
      <source>ALOGPS</source>
    </property>
    <property>
      <kind>logp</kind>
      <value>-0.0036</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>pka_strongest_basic</kind>
      <value>-7.8</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>iupac</kind>
      <value>oxaldehyde</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>average_mass</kind>
      <value>58.0361</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>mono_mass</kind>
      <value>58.005479308</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>smiles</kind>
      <value>O=CC=O</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>formula</kind>
      <value>C2H2O2</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>inchi</kind>
      <value>InChI=1S/C2H2O2/c3-1-2-4/h1-2H</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>inchikey</kind>
      <value>LEQAOMBKQFMDFZ-UHFFFAOYSA-N</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>polar_surface_area</kind>
      <value>34.14</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>refractivity</kind>
      <value>12.56</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>polarizability</kind>
      <value>4.5</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>rotatable_bond_count</kind>
      <value>1</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>acceptor_count</kind>
      <value>2</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>donor_count</kind>
      <value>0</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>physiological_charge</kind>
      <value>0</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>formal_charge</kind>
      <value>0</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:0x00007f72257c2088&gt;</health_effects>
  <symptoms/>
  <treatment/>
  <drugbank_id/>
  <hmdb_id/>
  <pubchem_compound_id>7860</pubchem_compound_id>
  <chembl_id/>
  <chemspider_id>7572</chemspider_id>
  <kegg_id/>
  <uniprot_id/>
  <omim_id/>
  <chebi_id/>
  <biocyc_id/>
  <ctd_id/>
  <stitch_id/>
  <actor_id/>
  <pdb_id/>
  <wikipidia/>
  <general_references/>
  <targets>
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</compound>
