4,5-Thiepanedione, 3,3,6,6-tetramethyl-
3,3,6,6-tetramethylthiepane-4,5-dione
Also Known As: 3,3,6,6-tetramethylthiepane-4,5-dione|4,5-Thiepanedione, 3,3,6,6-tetramethyl-|4, 3,3,6,6-tetramethyl-|EX-A13461R|3,3,6,6-Tetramethyl-4,5-thiepanedione|1,2-Cycloheptanedione-5-thia, 3,3,7,7-tetramethyl-|3,3,6,6-Tetramethyl-4,5-thiepanedione #
CAS: 2800-87-5
| Molecular Formula | C10H16O2S |
|---|---|
| Molecular Weight | 200.0871 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 59.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 200.0871 |
| Monoisotopic Mass | 200.0871 |
| Heavy Atoms | 13 |
| Complexity | 228.0 |
Chemical Identifiers
| CAS Number | 2800-87-5 |
|---|---|
| SMILES | CC1(CSCC(C(=O)C1=O)(C)C)C |
| InChIKey | GFZNLWBRSSKIQN-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Heterocyclic Building Blocks (15 patents)
Pharmaceutical Intermediates (7 patents)
Product Overview
4,5-Thiepanedione, 3,3,6,6-tetramethyl- (CAS 2800-87-5), with molecular formula C10H16O2S and molecular weight 200.0871 g/mol. IUPAC: 3,3,6,6-tetramethylthiepane-4,5-dione.
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 →
4,5-Thiepanedione, 3,3,6,6-tetramethyl- is a custom synthesis product. We offer services from milligram to kilogram scale.
Request a Quote »