4,5-Dihydrothiepin 1,1-dioxide
4,5-dihydrothiepine 1,1-dioxide
Also Known As: 4,1-dioxide|4,5-Dihydrothiepin 1,1-dioxide|4,5-dihydrothiepine 1,1-dioxide|Thiepin,5-dihydro-, 1,1-dioxide|Thiepin, 4,5-dihydro-, 1,1-dioxide|4,5-Dihydro-1H-1lambda~6~-thiepine-1,1-dione
CAS: 29520-87-4
| Molecular Formula | C6H8O2S |
|---|---|
| Molecular Weight | 144.0245 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 42.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 144.0245 |
| Monoisotopic Mass | 144.0245 |
| Heavy Atoms | 9 |
| Complexity | 208.0 |
Chemical Identifiers
| CAS Number | 29520-87-4 |
|---|---|
| SMILES | C1CC=CS(=O)(=O)C=C1 |
| InChIKey | FAQFAFHVYALEBP-UHFFFAOYSA-N |
Product Overview
4,5-Dihydrothiepin 1,1-dioxide (CAS 29520-87-4), with molecular formula C6H8O2S and molecular weight 144.0245 g/mol. IUPAC: 4,5-dihydrothiepine 1,1-dioxide.
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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