methyl 2-[(4-hydroxyphenyl)methylidene]-3-oxo-2,3-dihydro-1-benzofuran-5-carboxylate
Chemical Structure Depiction of
methyl 2-[(4-hydroxyphenyl)methylidene]-3-oxo-2,3-dihydro-1-benzofuran-5-carboxylate
methyl 2-[(4-hydroxyphenyl)methylidene]-3-oxo-2,3-dihydro-1-benzofuran-5-carboxylate
Compound characteristics
| Compound ID: | C711-0396 |
| Compound Name: | methyl 2-[(4-hydroxyphenyl)methylidene]-3-oxo-2,3-dihydro-1-benzofuran-5-carboxylate |
| Molecular Weight: | 296.28 |
| Molecular Formula: | C17 H12 O5 |
| Smiles: | [H]C(=C1/C(c2cc(ccc2O1)C(=O)OC)=O)\c1ccc(cc1)O |
| Stereo: | ACHIRAL |
| logP: | 3.098 |
| logD: | 3.0957 |
| logSw: | -3.269 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.154 |
| InChI Key: | PTQFQYKDIQOOMX-UHFFFAOYSA-N |