TL;DR: Sodium saccharin (CAS 128-44-9) is a chemical compound with molecular formula C7H4NNaO3S and molecular weight 204.98096 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
sodium 1,1-dioxo-1,2-benzothiazol-2-id-3-one
Also Known As: SACCHARIN SODIUM, Sodium saccharin, Sodium saccharine, Saccharin, sodium, Saccharinnatrium
Top 5 of 22 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C7H4NNaO3S |
| Molecular Weight | 204.98096 g/mol |
| XLogP | -2.0932 |
| Topological Polar Surface Area (TPSA) | 60.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 204.98096 Da |
| Heavy Atoms | 13 |
| Complexity | 308.0 |
| SMILES | C1=CC=C2C(=C1)C(=O)[N-]S2(=O)=O.[Na+] |
| InChIKey | WINXNKPZLFISPD-UHFFFAOYSA-M |
The XLogP value of -2.0932 indicates that Sodium saccharin is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 60.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Sodium saccharin. Following Lipinski's Rule of Five, Sodium saccharin has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Sodium saccharin is 128-44-9.
The molecular formula of Sodium saccharin is C7H4NNaO3S.
The molecular weight of Sodium saccharin is 204.98096 g/mol.
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