Saccharin calciumProduct ingredient for Saccharin
- Name
- Saccharin calcium
- Drug Entry
- Saccharin
Saccharin has been investigated for the treatment of Hypertension and Hyperglycemia.
- Accession Number
- DBSALT002238
- Structure
- Synonyms
- Not Available
- UNII
- 5101OP7P2I
- CAS Number
- 6381-91-5
- Weight
- Average: 530.53
Monoisotopic: 530.018922 - Chemical Formula
- C14H22CaN2O13S2
- InChI Key
- NNOYLBKZPCUCQT-UHFFFAOYSA-L
- InChI
- InChI=1S/2C7H5NO3S.Ca.7H2O/c2*9-7-5-3-1-2-4-6(5)12(10,11)8-7;;;;;;;;/h2*1-4H,(H,8,9);;7*1H2/q;;+2;;;;;;;/p-2
- IUPAC Name
- calcium bis(1,1,3-trioxo-2,3-dihydro-1lambda6,2-benzothiazol-2-ide) heptahydrate
- SMILES
- O.O.O.O.O.O.O.[Ca++].O=C1[N-]S(=O)(=O)C2=CC=CC=C12.O=C1[N-]S(=O)(=O)C2=CC=CC=C12
- External Links
- ChemSpider
- 30791836
- Predicted Properties
Property Value Source Water Solubility 0.0578 mg/mL ALOGPS logP 1.19 ALOGPS logP 0.45 Chemaxon logS -3.8 ALOGPS pKa (Strongest Acidic) 1.94 Chemaxon Physiological Charge -1 Chemaxon Hydrogen Acceptor Count 4 Chemaxon Hydrogen Donor Count 0 Chemaxon Polar Surface Area 60.44 Å2 Chemaxon Rotatable Bond Count 0 Chemaxon Refractivity 41.59 m3·mol-1 Chemaxon Polarizability 15.6 Å3 Chemaxon Number of Rings 4 Chemaxon Bioavailability 1 Chemaxon Rule of Five No Chemaxon Ghose Filter No Chemaxon Veber's Rule No Chemaxon MDDR-like Rule No Chemaxon