3-Phenyl-1,2-benzisothiazole
3-phenyl-1,2-benzothiazole
Also Known As: 3-phenyl-1,2-benzisothiazole|3-phenyl-1,2-benzothiazole|J1.528.328I
CAS: 70132-76-2
| Molecular Formula | C13H9NS |
|---|---|
| Molecular Weight | 211.04558 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 41.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 211.04558 |
| Monoisotopic Mass | 211.04558 |
| Heavy Atoms | 15 |
| Complexity | 213.0 |
Chemical Identifiers
| CAS Number | 70132-76-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=NSC3=CC=CC=C32 |
| InChIKey | ZWESUCPHTMPHNJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Heterocyclic Building Blocks (8 patents)
Pharmaceutical Intermediates (1 patents)
Product Overview
3-Phenyl-1,2-benzisothiazole (CAS 70132-76-2), with molecular formula C13H9NS and molecular weight 211.04558 g/mol. IUPAC: 3-phenyl-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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