<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <version>1.0</version>
  <creation_date>2010-04-08 22:10:38 UTC</creation_date>
  <update_date>2025-11-18 23:43:25 UTC</update_date>
  <accession>FDB013311</accession>
  <name>Potassium hydrogen sulfate (KHSO4)</name>
  <description>Food additive (seasoning); acidity regulator</description>
  <synonyms>
    <synonym>Acid potassium sulfate</synonym>
    <synonym>E515?</synonym>
    <synonym>Monopotassium hydrogen sulfate</synonym>
    <synonym>Monopotassium sulfate</synonym>
    <synonym>Potassium acid sulfate</synonym>
    <synonym>Potassium bisulfate</synonym>
    <synonym>Potassium bisulphate</synonym>
    <synonym>Potassium hydrogen sulfate</synonym>
    <synonym>Potassium hydrogen sulfate [UN2509] [Corrosive]</synonym>
    <synonym>Potassium hydrogen sulfate, solid</synonym>
    <synonym>Potassium hydrogensulphate</synonym>
    <synonym>Potassium hydrosulfate (KHSO4)</synonym>
    <synonym>Potassium sulfate (KHSO4)</synonym>
    <synonym>Potassium sulfate, KHSO4</synonym>
    <synonym>Sal enixum</synonym>
    <synonym>Sulfuric acid monopotassium salt</synonym>
    <synonym>Sulfuric acid potassium salt (1:1)</synonym>
    <synonym>Sulfuric acid, monopotassium salt</synonym>
    <synonym>Sulfuric acid, monopotassium salt, 8CI</synonym>
    <synonym>Sulfuric acid, potassium salt (1:1)</synonym>
  </synonyms>
  <chemical_formula>HKO4S</chemical_formula>
  <average_molecular_weight>136.169</average_molecular_weight>
  <monisotopic_moleculate_weight>135.923261071</monisotopic_moleculate_weight>
  <iupac_name>potassium hydrogen sulfate</iupac_name>
  <traditional_iupac>potassium hydrogen sulfate</traditional_iupac>
  <cas_registry_number>7646-93-7</cas_registry_number>
  <smiles>[K+].OS([O-])(=O)=O</smiles>
  <inchi>InChI=1S/K.H2O4S/c;1-5(2,3)4/h;(H2,1,2,3,4)/q+1;/p-1</inchi>
  <inchikey>CHKVPAROMQMJNQ-UHFFFAOYSA-M</inchikey>
  <taxonomy>
    <description> belongs to the class of inorganic compounds known as alkali metal sulfates. These are inorganic compounds in which the largest oxoanion is sulfate, and in which the heaviest atom not in an oxoanion is an alkali metal.</description>
    <direct_parent>Alkali metal sulfates</direct_parent>
    <kingdom>Inorganic compounds</kingdom>
    <super_class>Mixed metal/non-metal compounds</super_class>
    <class>Alkali metal oxoanionic compounds</class>
    <sub_class>Alkali metal sulfates</sub_class>
    <molecular_framework/>
    <alternative_parents>
      <alternative_parent>Inorganic oxides</alternative_parent>
      <alternative_parent>Inorganic salts</alternative_parent>
    </alternative_parents>
    <substituents>
      <substituent>Alkali metal sulfate</substituent>
      <substituent>Inorganic oxide</substituent>
      <substituent>Inorganic salt</substituent>
    </substituents>
    <external_descriptors>
    </external_descriptors>
  </taxonomy>
  <state/>
  <predicted_properties>
  </predicted_properties>
  <experimental_properties>
    <property>
      <kind>melting_point</kind>
      <value>Mp 214°</value>
    </property>
  </experimental_properties>
  <property>
    <kind>logp</kind>
    <value>-0.84</value>
    <source>ChemAxon</source>
  </property>
  <property>
    <kind>pka_strongest_acidic</kind>
    <value>-3</value>
    <source>ChemAxon</source>
  </property>
  <property>
    <kind>iupac</kind>
    <value>potassium hydrogen sulfate</value>
    <source>ChemAxon</source>
  </property>
  <property>
    <kind>average_mass</kind>
    <value>136.169</value>
    <source>ChemAxon</source>
  </property>
  <property>
    <kind>mono_mass</kind>
    <value>135.923261071</value>
    <source>ChemAxon</source>
  </property>
  <property>
    <kind>smiles</kind>
    <value>[K+].OS([O-])(=O)=O</value>
    <source>ChemAxon</source>
  </property>
  <property>
    <kind>formula</kind>
    <value>HKO4S</value>
    <source>ChemAxon</source>
  </property>
  <property>
    <kind>inchi</kind>
    <value>InChI=1S/K.H2O4S/c;1-5(2,3)4/h;(H2,1,2,3,4)/q+1;/p-1</value>
    <source>ChemAxon</source>
  </property>
  <property>
    <kind>inchikey</kind>
    <value>CHKVPAROMQMJNQ-UHFFFAOYSA-M</value>
    <source>ChemAxon</source>
  </property>
  <property>
    <kind>polar_surface_area</kind>
    <value>77.43</value>
    <source>ChemAxon</source>
  </property>
  <property>
    <kind>refractivity</kind>
    <value>12.65</value>
    <source>ChemAxon</source>
  </property>
  <property>
    <kind>polarizability</kind>
    <value>6.16</value>
    <source>ChemAxon</source>
  </property>
  <property>
    <kind>rotatable_bond_count</kind>
    <value>0</value>
    <source>ChemAxon</source>
  </property>
  <property>
    <kind>acceptor_count</kind>
    <value>4</value>
    <source>ChemAxon</source>
  </property>
  <property>
    <kind>donor_count</kind>
    <value>1</value>
    <source>ChemAxon</source>
  </property>
  <property>
    <kind>physiological_charge</kind>
    <value>-2</value>
    <source>ChemAxon</source>
  </property>
  <property>
    <kind>formal_charge</kind>
    <value>0</value>
    <source>ChemAxon</source>
  </property>
  <pathways>
  </pathways>
  <spectra>
    <spectrum>
      <type>Specdb::MsMs</type>
      <spectrum_id>1293415</spectrum_id>
    </spectrum>
    <spectrum>
      <type>Specdb::MsMs</type>
      <spectrum_id>1293416</spectrum_id>
    </spectrum>
    <spectrum>
      <type>Specdb::MsMs</type>
      <spectrum_id>1293417</spectrum_id>
    </spectrum>
    <spectrum>
      <type>Specdb::MsMs</type>
      <spectrum_id>1408099</spectrum_id>
    </spectrum>
    <spectrum>
      <type>Specdb::MsMs</type>
      <spectrum_id>1408100</spectrum_id>
    </spectrum>
    <spectrum>
      <type>Specdb::MsMs</type>
      <spectrum_id>1408101</spectrum_id>
    </spectrum>
  </spectra>
  <hmdb_id/>
  <pubchem_compound_id/>
  <chemspider_id/>
  <kegg_id/>
  <chebi_id/>
  <biocyc_id/>
  <het_id/>
  <wikipidia/>
  <vmh_id/>
  <fbonto_id/>
  <foodb_id/>
  <general_references>
  </general_references>
  <foods>
  </foods>
  <flavors>
  </flavors>
  <enzymes>
  </enzymes>
  <health_effects>
  </health_effects>
</compound>
