4-(2-oxo-2H-1-benzopyran-3-yl)benzoic acid
Chemical Structure Depiction of
4-(2-oxo-2H-1-benzopyran-3-yl)benzoic acid
4-(2-oxo-2H-1-benzopyran-3-yl)benzoic acid
Compound characteristics
| Compound ID: | Y043-6992 |
| Compound Name: | 4-(2-oxo-2H-1-benzopyran-3-yl)benzoic acid |
| Molecular Weight: | 266.25 |
| Molecular Formula: | C16 H10 O4 |
| Smiles: | C1=C(C(=O)Oc2ccccc12)c1ccc(cc1)C(O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1584 |
| logD: | -0.4484 |
| logSw: | -3.4701 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.297 |
| InChI Key: | MBBOXTWFFMVNRN-UHFFFAOYSA-N |