<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <version>1.0</version>
  <creation_date>2016-05-19 03:13:14 UTC</creation_date>
  <update_date>2026-04-16 22:29:23 UTC</update_date>
  <accession/>
  <common_name>Zeolites</common_name>
  <class>SmallMolecule</class>
  <description>Zeolites belongs to the post-transition metal oxides, a subclass of post-transition metal organides within the inorganic compounds. This mixed metal/non-metal compound has the formula Al2H6O5Si and an average molecular weight of 168.09 g/mol.

In industrial settings, zeolites serve a wide variety of roles and uses. They are utilized as chelating agents, anti-caking agents, absorbents, deodorizers, fillers, and anti-adhesive/cohesive agents. Additionally, they function as dehydrating agents (desiccants) and are categorized as processing aids not otherwise specified.

Zeolites are found in or released from 32 recorded sources. Within electrical and electronic equipment, they are present in antennas, coils, auxiliary devices, adjustable resistors, and communication cables or conductors, among 9 other items. In building and construction, they are found in floors, ceilings, roofs, fencing, and stairs and ramps, as well as one other source. Regarding household cleaning and consumer products, they are associated with tobacco pipes, ash trays, tobacco product cases, other smoking requisites, and pipe accessories, plus one additional source. In the category of food, food processing and cookware, zeolites are involved in the processing of fish, the treatment of hops, the preparation of wort, the preparation of vinegar, and brew kettles. Finally, they are found in household items such as credit card holders.</description>
  <categories/>
  <types/>
  <synonyms>
    <synonym>Zeolites other than erionite (clinoptilolite, phillipsite,mordenite, non-fibrous Japanese zeolite, synthetic zeolites)</synonym>
  </synonyms>
  <chemical_formula>Al2H6O5Si</chemical_formula>
  <average_molecular_weight>168.091</average_molecular_weight>
  <monisotopic_moleculate_weight>167.9615268</monisotopic_moleculate_weight>
  <iupac_name>silanedione dialumane trihydrate</iupac_name>
  <traditional_iupac>silica dialumane trihydrate</traditional_iupac>
  <cas_registry_number>1318-02-1</cas_registry_number>
  <smiles>O.O.O.[Al].[Al].O=[Si]=O</smiles>
  <inchi>InChI=1S/2Al.O2Si.3H2O/c;;1-3-2;;;/h;;;3*1H2</inchi>
  <inchikey>VMLBCOFWMYMGLE-UHFFFAOYSA-N</inchikey>
  <taxonomy>
    <kingdom>Inorganic compounds</kingdom>
    <super_class>Mixed metal/non-metal compounds</super_class>
    <class>Post-transition metal organides</class>
    <sub_class>Post-transition metal oxides</sub_class>
    <direct_parent>Post-transition metal oxides</direct_parent>
    <alternate_parents>
      <alternative_parent>Inorganic oxides</alternative_parent>
      <alternative_parent>Inorganic salts</alternative_parent>
      <alternative_parent>Metalloid salts</alternative_parent>
    </alternate_parents>
    <substituents>
      <substituent>Inorganic metalloid salt</substituent>
      <substituent>Inorganic oxide</substituent>
      <substituent>Inorganic salt</substituent>
      <substituent>Post-transition metal oxide</substituent>
    </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>logp</kind>
      <value>-0.66</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>pka_strongest_basic</kind>
      <value>-8.5</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>iupac</kind>
      <value>silanedione dialumane trihydrate</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>average_mass</kind>
      <value>168.091</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>mono_mass</kind>
      <value>167.9615268</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>smiles</kind>
      <value>O.O.O.[Al].[Al].O=[Si]=O</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>formula</kind>
      <value>Al2H6O5Si</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>inchi</kind>
      <value>InChI=1S/2Al.O2Si.3H2O/c;;1-3-2;;;/h;;;3*1H2</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>inchikey</kind>
      <value>VMLBCOFWMYMGLE-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>2.89</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>polarizability</kind>
      <value>3.28</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>rotatable_bond_count</kind>
      <value>0</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/>
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  <metabolism/>
  <toxicity/>
  <lethaldose/>
  <carcinogenicity/>
  <use_source/>
  <min_risk_level/>
  <health_effects>#&lt;HealthEffect::ActiveRecord_Associations_CollectionProxy:0x00007f3bf364eed0&gt;</health_effects>
  <symptoms/>
  <treatment/>
  <drugbank_id/>
  <hmdb_id/>
  <pubchem_compound_id>9942228</pubchem_compound_id>
  <chembl_id/>
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</compound>
