Acesulfame
TL;DR: Acesulfame (CAS 33665-90-6) is a chemical compound with molecular formula C4H5NO4S and molecular weight 162.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-methyl-2,2-dioxooxathiazin-4-one
Also Known As: Acetosulfam, Acesulfamo, Acesulfamum, acetosulfame, Acesulfam
| Molecular Formula | C4H5NO4S |
|---|---|
| Molecular Weight | 162.99 g/mol |
| LogP | -0.3 |
| Topological Polar Surface Area | 80.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 162.99393 |
| Heavy Atoms | 10 |
| Complexity | 283.0 |
| Melting Point | 123.2 °C |
| Density | 1.83 |
| Solubility | In water, 270 g/L at 20 °C |
Chemical Identifiers
| CAS Number | 33665-90-6 |
|---|---|
| SMILES | CC1=CC(=O)NS(=O)(=O)O1 |
| InChIKey | YGCFIWIQZPHFLU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 19 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Acesulfame (CAS 33665-90-6), with molecular formula C4H5NO4S and molecular weight 162.99 g/mol. IUPAC: 6-methyl-2,2-dioxooxathiazin-4-one.
Chemical Property Profile of Acesulfame
Property Insights of Acesulfame
The XLogP value of -0.3 indicates that Acesulfame is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 80.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Acesulfame. Following Lipinski's Rule of Five, Acesulfame has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Acesulfame?
The CAS number of Acesulfame is 33665-90-6.
What is the molecular formula of Acesulfame?
The molecular formula of Acesulfame is C4H5NO4S.
What is the molecular weight of Acesulfame?
The molecular weight of Acesulfame is 162.99 g/mol.
Where can I buy Acesulfame?
You can request a quote for Acesulfame directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Acesulfame?
Yes, KEHONG BIO provides custom synthesis services for Acesulfame and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.