4-(7-methoxy-2-oxo-2H-1-benzopyran-3-yl)benzoic acid
Chemical Structure Depiction of
4-(7-methoxy-2-oxo-2H-1-benzopyran-3-yl)benzoic acid
4-(7-methoxy-2-oxo-2H-1-benzopyran-3-yl)benzoic acid
Compound characteristics
| Compound ID: | D715-1650 |
| Compound Name: | 4-(7-methoxy-2-oxo-2H-1-benzopyran-3-yl)benzoic acid |
| Molecular Weight: | 296.28 |
| Molecular Formula: | C17 H12 O5 |
| Smiles: | COc1ccc2C=C(C(=O)Oc2c1)c1ccc(cc1)C(O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2623 |
| logD: | -0.3445 |
| logSw: | -3.463 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.84 |
| InChI Key: | XABGXVXXPAIMIX-UHFFFAOYSA-N |