4H-1-Benzothiopyran-4-one, 2,3-dihydro-3,3-dimethyl-, 1-oxide
3,3-dimethyl-1-oxo-2H-thiochromen-4-one
Also Known As: 3,3-dimethyl-1-oxo-2H-thiochromen-4-one|4H-1-Benzothiopyran-4-one, 2,3-dihydro-3,3-dimethyl-, 1-oxide|3,3-Dimethyl-2,3-dihydro-1-benzothiopyran-1,4-dione
CAS: 29976-33-8
| Molecular Formula | C11H12O2S |
|---|---|
| Molecular Weight | 208.0558 g/mol |
| LogP | 2.0167 |
| Topological Polar Surface Area | 34.14 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 208.0558 |
| Monoisotopic Mass | 208.0558 |
| Heavy Atoms | 14 |
| Complexity | 421.05063 |
Chemical Identifiers
| CAS Number | 29976-33-8 |
|---|---|
| SMILES | CC1(CS(=O)C2=CC=CC=C2C1=O)C |
Product Overview
4H-1-Benzothiopyran-4-one, 2,3-dihydro-3,3-dimethyl-, 1-oxide (CAS 29976-33-8), with molecular formula C11H12O2S and molecular weight 208.0558 g/mol. IUPAC: 3,3-dimethyl-1-oxo-2H-thiochromen-4-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.
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4H-1-Benzothiopyran-4-one, 2,3-dihydro-3,3-dimethyl-, 1-oxide is a custom synthesis product. We offer services from milligram to kilogram scale.
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