3-(1,3-Benzodioxol-5-ylmethylidene)-5-ethylthiophen-2-one
3-(1,3-benzodioxol-5-ylmethylidene)-5-ethylthiophen-2-one
Also Known As: ChemDiv3_000974|3-(1,3-benzodioxol-5-ylmethylidene)-5-ethylthiophen-2-one|(3E)-3-(1,3-benzodioxol-5-ylmethylidene)-5-ethylthiophen-2-o
CAS: 86239-20-5
| Molecular Formula | C14H12O3S |
|---|---|
| Molecular Weight | 260.05072 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 60.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 260.05072 |
| Monoisotopic Mass | 260.05072 |
| Heavy Atoms | 18 |
| Complexity | 413.0 |
Chemical Identifiers
| CAS Number | 86239-20-5 |
|---|---|
| SMILES | CCC1=CC(=CC2=CC3=C(C=C2)OCO3)C(=O)S1 |
| InChIKey | BUOREIVKKAYCJA-UHFFFAOYSA-N |
Product Overview
3-(1,3-Benzodioxol-5-ylmethylidene)-5-ethylthiophen-2-one (CAS 86239-20-5), with molecular formula C14H12O3S and molecular weight 260.05072 g/mol. IUPAC: 3-(1,3-benzodioxol-5-ylmethylidene)-5-ethylthiophen-2-one.
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 →
3-(1,3-Benzodioxol-5-ylmethylidene)-5-ethylthiophen-2-one is a custom synthesis product. We offer services from milligram to kilogram scale.
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