Methyl 5-(dithiolan-3-yl)pentanoate
methyl 5-(dithiolan-3-yl)pentanoate
Also Known As: Methyl lipoate|Methyl thioctate|Methyl 5-(dithiolan-3-yl)pentanoate|Thioctic Acid Impurity 43|Lipoic Acid Impurity 17|methyl 5-(1,2-dithiolan-3-yl)pentanoate|PVXPIJICTUHMAO-UHFFFAOYSA|1,2-Dithiolane-3-pentanoic acid, methyl ester|PVXPIJICTUHMAO-UHFFFAOYSA-|1,2-Dithiolane-3-valeric acid methyl ester|1,2-Dithiolane-3-pentanoic acid methyl ester
CAS: 46236-19-5
| Molecular Formula | C9H16O2S2 |
|---|---|
| Molecular Weight | 220.05917 g/mol |
| LogP | 2.8735 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 220.05917 |
| Monoisotopic Mass | 220.05917 |
| Heavy Atoms | 13 |
| Complexity | 155.6937 |
Chemical Identifiers
| CAS Number | 46236-19-5 |
|---|---|
| SMILES | COC(=O)CCCCC1CCSS1 |
Product Overview
Methyl 5-(dithiolan-3-yl)pentanoate (CAS 46236-19-5), with molecular formula C9H16O2S2 and molecular weight 220.05917 g/mol. IUPAC: methyl 5-(dithiolan-3-yl)pentanoate.
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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