butyl 6-bromo-2-oxo-2H-1-benzopyran-3-carboxylate
Chemical Structure Depiction of
butyl 6-bromo-2-oxo-2H-1-benzopyran-3-carboxylate
butyl 6-bromo-2-oxo-2H-1-benzopyran-3-carboxylate
Compound characteristics
| Compound ID: | 4315-0714 |
| Compound Name: | butyl 6-bromo-2-oxo-2H-1-benzopyran-3-carboxylate |
| Molecular Weight: | 325.16 |
| Molecular Formula: | C14 H13 Br O4 |
| Smiles: | CCCCOC(C1=Cc2cc(ccc2OC1=O)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 3.857 |
| logD: | 3.857 |
| logSw: | -3.9533 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 42.208 |
| InChI Key: | FQVCQSVPNKJZBR-UHFFFAOYSA-N |