3-(thiophene-2-carbonyl)-7,9-dioxatricyclo[4.2.1.0~2,4~]nonan-5-one
Chemical Structure Depiction of
3-(thiophene-2-carbonyl)-7,9-dioxatricyclo[4.2.1.0~2,4~]nonan-5-one
3-(thiophene-2-carbonyl)-7,9-dioxatricyclo[4.2.1.0~2,4~]nonan-5-one
Compound characteristics
| Compound ID: | 8006-9890 |
| Compound Name: | 3-(thiophene-2-carbonyl)-7,9-dioxatricyclo[4.2.1.0~2,4~]nonan-5-one |
| Molecular Weight: | 250.27 |
| Molecular Formula: | C12 H10 O4 S |
| Smiles: | C1C2C3C(C3C(c3cccs3)=O)C(C(O1)O2)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 1.2058 |
| logD: | 1.2058 |
| logSw: | -1.7613 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 45.925 |
| InChI Key: | ACMDDNLMMKJLPC-UHFFFAOYSA-N |