Ethyl 3-(phenylsulfanyl)but-2-enoate
ethyl 3-phenylsulfanylbut-2-enoate
Also Known As: Ethyl 3-(phenylsulfanyl)but-2-enoate|ethyl 3-phenylsulfanylbut-2-enoate|cis-3-Phenylthio-crotonsaeure-aethylester|2-Butenoic acid, 3-(phenylthio)-, ethyl ester, (2E)-
CAS: 21017-20-9
| Molecular Formula | C12H14O2S |
|---|---|
| Molecular Weight | 222.07146 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 51.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 222.07146 |
| Monoisotopic Mass | 222.07146 |
| Heavy Atoms | 15 |
| Complexity | 230.0 |
Chemical Identifiers
| CAS Number | 21017-20-9 |
|---|---|
| SMILES | CCOC(=O)C=C(C)SC1=CC=CC=C1 |
| InChIKey | GRYPWQYBOWSOTR-UHFFFAOYSA-N |
Product Overview
Ethyl 3-(phenylsulfanyl)but-2-enoate (CAS 21017-20-9), with molecular formula C12H14O2S and molecular weight 222.07146 g/mol. IUPAC: ethyl 3-phenylsulfanylbut-2-enoate.
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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