Determine the necessary mass, volume, or concentration for preparing a solution.
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| SKU | Size | Availability |
Price | Qty |
|---|---|---|---|---|
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S298558-25g
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25g |
Available within 4-8 weeks(?)
Items will be manufactured post-order and can take 4-8 weeks. Thank you for your patience!
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$12.90
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S298558-100g
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100g |
2
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$34.90
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S298558-500g
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500g |
3
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$120.90
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| Synonyms | AI3-38107 | 1,1-Dioxide-1,2-benzisothiazolin-3-one | HSDB 669 | 1,2-Dihydro-2-ketobenzisosulphonazole | Benzosulfinide | 3-Hydroxybenzisothiazole-S,S-dioxide | Anhydro-o-sulfaminebenzoic acid | o-Benzoic sulfimide | Benzo-sulphinide | Kristallose | SACCHA |
|---|---|
| Specifications & Purity | Moligand™, ≥97% |
| Storage Temp | Argon charged |
| Shipped In | Normal |
| Grade | Moligand™ |
| Product Description |
Usually used in high performance liquid chromatographic method for the simultaneous separation and determination of acesulfame potassium, saccharine and aspartame;and also used in sweet preference test of rats. |
Taxonomy Tree
| Kingdom | Organic compounds |
|---|---|
| Superclass | Organoheterocyclic compounds |
| Class | Benzothiazoles |
| Subclass | Not available |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Benzothiazoles |
| Alternative Parents | Benzenoids Organosulfonic acids and derivatives Carboxylic acids and derivatives Azacyclic compounds Organopnictogen compounds Organooxygen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives |
| Molecular Framework | Aromatic heteropolycyclic compounds |
| Substituents | 1,2-benzothiazole - Benzenoid - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Azacycle - Carboxylic acid derivative - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Aromatic heteropolycyclic compound |
| Description | This compound belongs to the class of organic compounds known as benzothiazoles. These are organic compounds containing a benzene fused to a thiazole ring (a five-membered ring with four carbon atoms, one nitrogen atom and one sulfur atom). |
| External Descriptors | sulfone - lactam - 1,2-benzisothiazole |
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| Mechanism of Action | Action Type | target ID | Target Name | Target Type | Target Organism | Binding Site Name | References |
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| Pubchem Sid | 504750846 |
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| Pubchem Sid Url | https://pubchem.ncbi.nlm.nih.gov/substance/504750846 |
| IUPAC Name | 1,1-dioxo-1,2-benzothiazol-3-one |
| INCHI | InChI=1S/C7H5NO3S/c9-7-5-3-1-2-4-6(5)12(10,11)8-7/h1-4H,(H,8,9) |
| InChIKey | CVHZOJJKTDOEJC-UHFFFAOYSA-N |
| Smiles | C1=CC=C2C(=C1)C(=O)NS2(=O)=O |
| Isomeric SMILES | C1=CC=C2C(=C1)C(=O)NS2(=O)=O |
| WGK Germany | 2 |
| RTECS | DE4200000 |
| Alternate CAS | 128-44-9,6381-61-9,81-07-2 |
| PubChem CID | 5143 |
| NSC Number | 5349 |
| MeSH Entry Terms | Calcium, Saccharin;Saccharin;Saccharin Calcium;Saccharin Sodium |
| Molecular Weight | 183.18 |
| Beilstein | 6888 |
| Reaxy-Rn | 6888 |
Find and download the COA for your product by matching the lot number on the packaging.
| Lot Number | Certificate Type | Date | Item |
|---|---|---|---|
| Certificate of Analysis | May 21, 2025 | S298558 | |
| Certificate of Analysis | Apr 28, 2024 | S298558 | |
| Certificate of Analysis | Apr 15, 2024 | S298558 | |
| Certificate of Analysis | Dec 10, 2022 | S298558 | |
| Certificate of Analysis | May 09, 2022 | S298558 | |
| Certificate of Analysis | May 09, 2022 | S298558 |
| Sensitivity | Moisture sensitive |
|---|---|
| Melt Point(°C) | 229°C |
| Molecular Weight | 183.190 g/mol |
| XLogP3 | 0.900 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 0 |
| Exact Mass | 182.999 Da |
| Monoisotopic Mass | 182.999 Da |
| Topological Polar Surface Area | 71.600 Ų |
| Heavy Atom Count | 12 |
| Formal Charge | 0 |
| Complexity | 303.000 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| The total count of all stereochemical bonds | 0 |
| Covalently-Bonded Unit Count | 1 |
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