2-Tert-butyl-1,3-dithiane
2-tert-butyl-1,3-dithiane
Also Known As: 2-tert-butyl-1,3-dithiane|2-t-butyl-1,3-dithiane|m-Dithiane, 2-tert-butyl-|2-tert-butyl[1,3]dithiane|2-tert-Butyl-[1,3]dithiane|2-(tert-butyl)-1,3-dithiane|1,3-dithiane, 2-(1,1-dimethylethyl)-
CAS: 6007-21-2
| Molecular Formula | C8H16S2 |
|---|---|
| Molecular Weight | 176.06934 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 50.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 176.06934 |
| Monoisotopic Mass | 176.06934 |
| Heavy Atoms | 10 |
| Complexity | 98.0 |
Chemical Identifiers
| CAS Number | 6007-21-2 |
|---|---|
| SMILES | CC(C)(C)C1SCCCS1 |
| InChIKey | HDAJEWAEOHZUKQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Agrochemicals (2 patents)
Heterocyclic Building Blocks (4 patents)
Organometallic Reagents (2 patents)
Product Overview
2-Tert-butyl-1,3-dithiane (CAS 6007-21-2), with molecular formula C8H16S2 and molecular weight 176.06934 g/mol. IUPAC: 2-tert-butyl-1,3-dithiane.
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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