2-Butyl-1,1-dioxo-1,2-benzothiazol-3-one
2-butyl-1,1-dioxo-1,2-benzothiazol-3-one
Also Known As: Butylbenisothiazolene|n-Butylsaccharin|CBMicro_023647|Oprea1_518612|2-butyl-1,1-dioxo-1,2-benzothiazol-3-one|2-Butylbenzo[d]isothiazol-3(2H)-one 1,1-dioxide|BIM-0023395.P001|2-Butyl-1H-1lambda~6~,2-benzothiazole-1,1,3(2H)-trione|2-butyl-1,2-benzothiazol-3(2H)-one 1,1-dioxide|SR-01000104132-1|2-BUTYL-1??,2-BENZOTHIAZOLE-1,1,3-TRIONE|1,2-Benzisothiazol-3(2H)-one, 2-butyl-, 1,1-dioxide|2-n-Butyl-1,2-benzisothiazol-3(2H)-one 1,1-dioxide
| Molecular Formula | C11H13NO3S |
|---|---|
| Molecular Weight | 239.06161 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 62.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 239.06161 |
| Monoisotopic Mass | 239.06161 |
| Heavy Atoms | 16 |
| Complexity | 371.0 |
Chemical Identifiers
| CAS Number | 7499-96-9 |
|---|---|
| SMILES | CCCCN1C(=O)C2=CC=CC=C2S1(=O)=O |
| InChIKey | OVHVVWXDKDMZQA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Butyl-1,1-dioxo-1,2-benzothiazol-3-one (CAS 7499-96-9), with molecular formula C11H13NO3S and molecular weight 239.06161 g/mol. IUPAC: 2-butyl-1,1-dioxo-1,2-benzothiazol-3-one.