1,2-Benzisothiazole, 7-nitro-
7-nitro-1,2-benzothiazole
Also Known As: 7-Nitro-1,2-benzisothiazole|1,2-Benzisothiazole, 7-nitro-|7-nitrobenzisothiazole|7-nitro-1,2-benzothiazole|Benzo[d]isothiazol-5-ol|7-Nitrobenzo[d]isothiazole
CAS: 75608-07-0
| Molecular Formula | C7H4N2O2S |
|---|---|
| Molecular Weight | 179.99934 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 87.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 179.99934 |
| Monoisotopic Mass | 179.99934 |
| Heavy Atoms | 12 |
| Complexity | 194.0 |
Chemical Identifiers
| CAS Number | 75608-07-0 |
|---|---|
| SMILES | C1=CC2=C(C(=C1)[N+](=O)[O-])SN=C2 |
| InChIKey | XYFHXKUXMXHTPU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Agrochemicals (3 patents)
Heterocyclic Building Blocks (7 patents)
Organic Building Blocks (2 patents)
Pharmaceutical Intermediates (1 patents)
Product Overview
1,2-Benzisothiazole, 7-nitro- (CAS 75608-07-0), with molecular formula C7H4N2O2S and molecular weight 179.99934 g/mol. IUPAC: 7-nitro-1,2-benzothiazole.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
View MSDS →
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