Methyl 4-(methylthio)butyrate
methyl 4-methylsulfanylbutanoate
| Molecular Formula | C6H12O2S |
|---|---|
| Molecular Weight | 148.23 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 51.6 A2 |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 148.0558 |
| Heavy Atoms | 9 |
| Complexity | 83.0 |
Chemical Identifiers
| CAS Number | 53053-51-3 |
|---|---|
| SMILES | COC(=O)CCCSC |
| InChIKey | HQDLZISNHUMXEA-UHFFFAOYSA-N |
📖 Product Overview
Methyl 4-(methylthio)butyrate (CAS: 53053-51-3) is a chemical compound with molecular formula C6H12O2S and molecular weight 148.23 g/mol. Its IUPAC systematic name is methyl 4-methylsulfanylbutanoate.
HQDLZISNHUMXEA-UHFFFAOYSA-N.
SMILES: COC(=O)CCCSC.
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