1,3-Benzoxathiol-2-one
1,3-benzoxathiol-2-one
Also Known As: 1,3-Benzoxathiol-2-one|1,3-Benzoxathiole-2-one|2H-1,3-benzoxathiol-2-one|benzo[d][1,3]oxathiol-2-one|J1.077.943J
CAS: 7735-53-7
| Molecular Formula | C7H4O2S |
|---|---|
| Molecular Weight | 151.9932 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 51.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 151.9932 |
| Monoisotopic Mass | 151.9932 |
| Heavy Atoms | 10 |
| Complexity | 158.0 |
Chemical Identifiers
| CAS Number | 7735-53-7 |
|---|---|
| SMILES | C1=CC=C2C(=C1)OC(=O)S2 |
| InChIKey | HDNWKCSXXBAGHD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.
Agrochemicals (8 patents)
Coatings & Adhesives (1 patents)
Heterocyclic Building Blocks (29 patents)
Organometallic Reagents (1 patents)
Paper Chemicals (8 patents)
Pharmaceutical Intermediates (22 patents)
Polymer Intermediates (21 patents)
Surfactants & Detergents (4 patents)
Textile Chemicals (5 patents)
Product Overview
1,3-Benzoxathiol-2-one (CAS 7735-53-7), with molecular formula C7H4O2S and molecular weight 151.9932 g/mol. IUPAC: 1,3-benzoxathiol-2-one.
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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