<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <version>1.0</version>
  <creation_date>2026-04-03 09:42:46 UTC</creation_date>
  <update_date>2026-08-24 17:07:46 UTC</update_date>
  <accession/>
  <common_name>2,2,5,5-Tetramethyltetrahydrofuran</common_name>
  <class>SmallMolecule</class>
  <description>2,2,5,5-Tetramethyltetrahydrofuran belongs to the tetrahydrofurans, a class of organoheterocyclic compounds within the organic compounds. This compound has the formula C8H16O1 and an average molecular weight of 128.22 g/mol. It has been identified in one recorded source: indoor air, dust, and atmospheric transport. The recorded exposure route for this substance is inhalation.</description>
  <categories/>
  <types/>
  <synonyms>
    <synonym>15045439</synonym>
    <synonym>2,2,5,5-Tetramethyl tetrahydrofuran</synonym>
    <synonym>2,2,5,5-tetramethyloxolane</synonym>
    <synonym>2,2,5,5-tetramethyltetrahydrofuran</synonym>
    <synonym>239-117-9</synonym>
    <synonym>EINECS 239-117-9</synonym>
    <synonym>Furan, tetrahydro-2,2,5,5-tetramethyl-</synonym>
    <synonym>Furan,tetrahydro-2,2,5,5-tetramethyl-</synonym>
    <synonym>MFCD00005368</synonym>
    <synonym>Tetrahydro-2,2,5,5-tetramethylfuran</synonym>
    <synonym>tetrahydrofuran, 2,2,5,5-tetramethyl-</synonym>
    <synonym>UNII-83Z08D4U0T</synonym>
    <synonym>UNII:83Z08D4U0T</synonym>
  </synonyms>
  <chemical_formula>C8H16O1</chemical_formula>
  <average_molecular_weight>128.215</average_molecular_weight>
  <monisotopic_moleculate_weight>128.120115</monisotopic_moleculate_weight>
  <iupac_name>2,2,5,5-tetramethyloxolane</iupac_name>
  <traditional_iupac>2,2,5,5-tetramethyloxolane</traditional_iupac>
  <cas_registry_number>15045-43-9</cas_registry_number>
  <smiles>CC1(C)CCC(C)(C)O1</smiles>
  <inchi>InChI=1S/C8H16O/c1-7(2)5-6-8(3,4)9-7/h5-6H2,1-4H3</inchi>
  <inchikey>BBLDTXFLAHKYFJ-UHFFFAOYSA-N</inchikey>
  <taxonomy>
    <kingdom>Organic compounds</kingdom>
    <super_class>Organoheterocyclic compounds</super_class>
    <class>Tetrahydrofurans</class>
    <sub_class/>
    <direct_parent>Tetrahydrofurans</direct_parent>
    <alternate_parents>
      <alternative_parent>Dialkyl ethers</alternative_parent>
      <alternative_parent>Hydrocarbon derivatives</alternative_parent>
      <alternative_parent>Oxacyclic compounds</alternative_parent>
    </alternate_parents>
    <substituents>
      <substituent>Aliphatic heteromonocyclic compound</substituent>
      <substituent>Dialkyl ether</substituent>
      <substituent>Ether</substituent>
      <substituent>Hydrocarbon derivative</substituent>
      <substituent>Organic oxygen compound</substituent>
      <substituent>Organooxygen compound</substituent>
      <substituent>Oxacycle</substituent>
      <substituent>Tetrahydrofuran</substituent>
    </substituents>
    <molecular_framework>Aliphatic heteromonocyclic compounds</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>2.1</value>
    </property>
  </experimental_properties>
  <predicted_properties>
    <property>
      <kind>logp</kind>
      <value>2.67</value>
      <source>ALOGPS</source>
    </property>
    <property>
      <kind>logs</kind>
      <value>-2.20</value>
      <source>ALOGPS</source>
    </property>
    <property>
      <kind>solubility</kind>
      <value>8.07e-01 g/l</value>
      <source>ALOGPS</source>
    </property>
    <property>
      <kind>logp</kind>
      <value>1.92</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>pka_strongest_basic</kind>
      <value>-4.2</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>iupac</kind>
      <value>2,2,5,5-tetramethyloxolane</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>average_mass</kind>
      <value>128.215</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>mono_mass</kind>
      <value>128.120115</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>smiles</kind>
      <value>CC1(C)CCC(C)(C)O1</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>formula</kind>
      <value>C8H16O1</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>inchi</kind>
      <value>InChI=1S/C8H16O/c1-7(2)5-6-8(3,4)9-7/h5-6H2,1-4H3</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>inchikey</kind>
      <value>BBLDTXFLAHKYFJ-UHFFFAOYSA-N</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>polar_surface_area</kind>
      <value>9.23</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>refractivity</kind>
      <value>38.67</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>polarizability</kind>
      <value>15.67</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>rotatable_bond_count</kind>
      <value>0</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>acceptor_count</kind>
      <value>1</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/>
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  <metabolism/>
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  <lethaldose/>
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  <use_source/>
  <min_risk_level/>
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  <symptoms/>
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  <hmdb_id/>
  <pubchem_compound_id>27010</pubchem_compound_id>
  <chembl_id/>
  <chemspider_id>25151</chemspider_id>
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</compound>
