thioacetic acid S-(3-oxo-undecyl) ester
S-(3-oxoundecyl) ethanethioate
Also Known As: 1-acetylsulfanylundecan-3-one|1-acetylsulfanyl-undecan-3-one|S-(3-oxoundecyl) ethanethioate|thioacetic acid S-(3-oxo-undecyl) ester|S-(3-oxoundecyl) ethanethioate (en)Ethanethioic acid, S-(3-o|S-(3-oxoundecyl) ethanethioate (en)Ethanethioic acid, S-(3-oxoundecyl) ester (en)
CAS: 33796-36-0
| Molecular Formula | C13H24O2S |
|---|---|
| Molecular Weight | 244.1497 g/mol |
| LogP | 3.9759 |
| Topological Polar Surface Area | 34.14 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 10 |
| Exact Mass | 244.1497 |
| Monoisotopic Mass | 244.1497 |
| Heavy Atoms | 16 |
| Complexity | 202.10927 |
Chemical Identifiers
| CAS Number | 33796-36-0 |
|---|---|
| SMILES | CCCCCCCCC(=O)CCSC(=O)C |
Product Overview
thioacetic acid S-(3-oxo-undecyl) ester (CAS 33796-36-0), with molecular formula C13H24O2S and molecular weight 244.1497 g/mol. IUPAC: S-(3-oxoundecyl) ethanethioate.
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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