3-Benzylthiopropionic acid
4-phenylbutanethioic S-acid
Also Known As: 3-benzylthiopropionic acid|4-phenylbutanethioic S-acid|4-phenylbutanethioic Acid|3-benzylthio propionic acid|3-Benzyl(thiopropionic acid)
CAS: 2899-66-3
| Molecular Formula | C10H12OS |
|---|---|
| Molecular Weight | 180.06088 g/mol |
| LogP | 2.4657 |
| Topological Polar Surface Area | 17.07 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 180.06088 |
| Monoisotopic Mass | 180.06088 |
| Heavy Atoms | 12 |
| Complexity | 243.27531 |
Chemical Identifiers
| CAS Number | 2899-66-3 |
|---|---|
| SMILES | C1=CC=C(C=C1)CCCC(=O)S |
Product Overview
3-Benzylthiopropionic acid (CAS 2899-66-3), with molecular formula C10H12OS and molecular weight 180.06088 g/mol. IUPAC: 4-phenylbutanethioic S-acid.
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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