benzyl 2-oxo-2H-1-benzopyran-3-carboxylate
Chemical Structure Depiction of
benzyl 2-oxo-2H-1-benzopyran-3-carboxylate
benzyl 2-oxo-2H-1-benzopyran-3-carboxylate
Compound characteristics
| Compound ID: | 8005-8490 |
| Compound Name: | benzyl 2-oxo-2H-1-benzopyran-3-carboxylate |
| Molecular Weight: | 280.28 |
| Molecular Formula: | C17 H12 O4 |
| Smiles: | C(c1ccccc1)OC(C1=Cc2ccccc2OC1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2067 |
| logD: | 3.2067 |
| logSw: | -3.3773 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 42.018 |
| InChI Key: | TWXSEJRQEDMZKQ-UHFFFAOYSA-N |