5,5-Dimethylhexane-1-thiol
5,5-dimethylhexane-1-thiol
Also Known As: tert-Octyl mercaptan|5,5-dimethylhexane-1-thiol
CAS: 7341-16-4
| Molecular Formula | C8H18S |
|---|---|
| Molecular Weight | 146.11292 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 1.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 146.11292 |
| Monoisotopic Mass | 146.11292 |
| Heavy Atoms | 9 |
| Complexity | 61.0 |
Chemical Identifiers
| CAS Number | 7341-16-4 |
|---|---|
| SMILES | CC(C)(C)CCCCS |
| InChIKey | YBZXKSZKVDFBJI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Agrochemicals (2 patents)
Heterocyclic Building Blocks (22 patents)
Organic Building Blocks (1 patents)
Organometallic Reagents (2 patents)
Peptides & Amino Acids (45 patents)
Pharmaceutical Intermediates (53 patents)
Product Overview
5,5-Dimethylhexane-1-thiol (CAS 7341-16-4), with molecular formula C8H18S and molecular weight 146.11292 g/mol. IUPAC: 5,5-dimethylhexane-1-thiol.
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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