propan-2-yl 6-bromo-2-oxo-2H-1-benzopyran-3-carboxylate
Chemical Structure Depiction of
propan-2-yl 6-bromo-2-oxo-2H-1-benzopyran-3-carboxylate
propan-2-yl 6-bromo-2-oxo-2H-1-benzopyran-3-carboxylate
Compound characteristics
| Compound ID: | 4315-0712 |
| Compound Name: | propan-2-yl 6-bromo-2-oxo-2H-1-benzopyran-3-carboxylate |
| Molecular Weight: | 311.13 |
| Molecular Formula: | C13 H11 Br O4 |
| Smiles: | CC(C)OC(C1=Cc2cc(ccc2OC1=O)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 3.2451 |
| logD: | 3.2451 |
| logSw: | -3.5079 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 41.593 |
| InChI Key: | ZOPFZOGPAOLXBH-UHFFFAOYSA-N |