methyl 2,4-dioxo-4-(thiophen-2-yl)butanoate
Chemical Structure Depiction of
methyl 2,4-dioxo-4-(thiophen-2-yl)butanoate
methyl 2,4-dioxo-4-(thiophen-2-yl)butanoate
Compound characteristics
| Compound ID: | Y503-3019 |
| Compound Name: | methyl 2,4-dioxo-4-(thiophen-2-yl)butanoate |
| Molecular Weight: | 212.22 |
| Molecular Formula: | C9 H8 O4 S |
| Smiles: | COC(C(CC(c1cccs1)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.057 |
| logD: | 0.9222 |
| logSw: | -1.8383 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 48.924 |
| InChI Key: | NBLQZHPVSHJRML-UHFFFAOYSA-N |