5-Methylheptyl 3-mercaptopropionate
5-methylheptyl 3-sulfanylpropanoate
Also Known As: 5-Methylheptyl 3-mercaptopropionate|5-methylheptyl 3-sulfanylpropanoate|EINECS 255-173-7|3-Mercaptopropanoic acid 5-methylheptyl ester
CAS: 41004-47-1
| Molecular Formula | C11H22O2S |
|---|---|
| Molecular Weight | 218.13405 g/mol |
| LogP | 3.0659 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 8 |
| Exact Mass | 218.13405 |
| Monoisotopic Mass | 218.13405 |
| Heavy Atoms | 14 |
| Complexity | 148.22296 |
Chemical Identifiers
| CAS Number | 41004-47-1 |
|---|---|
| SMILES | CCC(C)CCCCOC(=O)CCS |
Product Overview
5-Methylheptyl 3-mercaptopropionate (CAS 41004-47-1), with molecular formula C11H22O2S and molecular weight 218.13405 g/mol. IUPAC: 5-methylheptyl 3-sulfanylpropanoate.
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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