ACESULFAME POTASSIUM
Relevant Data
Food Additives Approved by WHO:
Food Additives Approved by European Union:
General Information
| Mainterm | ACESULFAME POTASSIUM |
| Doc Type | ASP |
| CAS Reg.No.(or other ID) | 55589-62-3 |
| Regnum |
172.800 |
From www.fda.gov
Computed Descriptors
Download SDF| 2D Structure | |
| CID | 11074431 |
| IUPAC Name | potassium;6-methyl-2,2-dioxo-1-oxa-2$l^{6}-thia-3-azanidacyclohex-5-en-4-one |
| InChI | InChI=1S/C4H5NO4S.K/c1-3-2-4(6)5-10(7,8)9-3;/h2H,1H3,(H,5,6);/q;+1/p-1 |
| InChI Key | WBZFUFAFFUEMEI-UHFFFAOYSA-M |
| Canonical SMILES | CC1=CC(=O)[N-]S(=O)(=O)O1.[K+] |
| Molecular Formula | C4H4KNO4S |
| Wikipedia | acesulfame potassium |
From Pubchem
Computed Properties
| Property Name | Property Value |
|---|---|
| Molecular Weight | 201.237 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 0 |
| Complexity | 288.0 |
| CACTVS Substructure Key Fingerprint | A A A D c Y B i O A B A Q A A A A A A A A A A A A A A A A A A A A A A g A A A A A A A A A A A A A A A A H g A A Q A A A C A S B g A A C A A A A A A C I A C F S E D C A A A A A I A A A C A A A A E A A A A A A A Q A A A A A A A A A A A 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 = = |
| Topological Polar Surface Area | 69.8 |
| Monoisotopic Mass | 200.95 |
| Exact Mass | 200.95 |
| Compound Is Canonicalized | True |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| 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 | Organic compounds |
|---|---|
| Superclass | Organic acids and derivatives |
| Class | Organic sulfuric acids and derivatives |
| Subclass | Not available |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Organic sulfuric acids and derivatives |
| Alternative Parents | |
| Molecular Framework | Aliphatic heteromonocyclic compounds |
| Substituents | Organic sulfuric acid or derivatives - Carboxylic acid derivative - Carbene-type 1,3-dipolar compound - Organic 1,3-dipolar compound - Organoheterocyclic compound - Organic alkali metal salt - Azacycle - Oxacycle - Organic potassium salt - Organic nitrogen compound - Organic salt - Organonitrogen compound - Organooxygen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Aliphatic heteromonocyclic compound |
| Description | This compound belongs to the class of organic compounds known as organic sulfuric acids and derivatives. These are organic compounds containing the sulfuric acid or a derivative thereof. |
From ClassyFire