POTASSIUM CHLORATE
General Information
| Chemical Names: | POTASSIUM CHLORATE |
| CAS number: | 3811-04-9 |
| Functional Class: |
Food Additives FLOUR_TREATMENT_AGENT BLEACHING_AGENT |
From apps.who.int
Evaluations
| Evaluation year: | 1969 |
| ADI: | NOT TO BE USED |
| Meeting: | 13 |
| Specs Code: | O; ID Only |
| Report: | NMRS 46/TRS 445-JECFA 13/21 |
| Tox Monograph: | NOT PREPARED |
| Specification: | FAS 70.37/NMRS 46B-JECFA 13/124 |
From apps.who.int
Computed Descriptors
Download SDF| 2D Structure | |
| CID | 6426889 |
| IUPAC Name | potassium;chlorate |
| InChI | InChI=1S/ClHO3.K/c2-1(3)4;/h(H,2,3,4);/q;+1/p-1 |
| InChI Key | VKJKEPKFPUWCAS-UHFFFAOYSA-M |
| Canonical SMILES | [O-]Cl(=O)=O.[K+] |
| Molecular Formula | ClKO3 |
| Wikipedia | potassium chlorate |
From Pubchem
Computed Properties
| Property Name | Property Value |
|---|---|
| Molecular Weight | 122.545 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 0 |
| Complexity | 49.8 |
| CACTVS Substructure Key Fingerprint | A A A D c Q A A M A A E Q A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A = = |
| Topological Polar Surface Area | 57.2 |
| Monoisotopic Mass | 121.917 |
| Exact Mass | 121.917 |
| Compound Is Canonicalized | True |
| Formal Charge | 0 |
| Heavy Atom Count | 5 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Isotope Atom Count | 0 |
| Covalently-Bonded Unit Count | 2 |
From Pubchem
Taxonomic Classification
| Kingdom | Inorganic compounds |
|---|---|
| Superclass | Mixed metal/non-metal compounds |
| Class | Alkali metal oxoanionic compounds |
| Subclass | Alkali metal chlorates |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Alkali metal chlorates |
| Alternative Parents | |
| Molecular Framework | Not available |
| Substituents | Alkali metal chlorate - Inorganic oxide - Inorganic salt |
| Description | This compound belongs to the class of inorganic compounds known as alkali metal chlorates. These are inorganic compounds in which the largest oxoanion is chlorate, and in which the heaviest atom not in an oxoanion is an alkali metal. |
From ClassyFire