phenyl 6,8-dichloro-2-oxo-2H-1-benzopyran-3-carboxylate
Chemical Structure Depiction of
phenyl 6,8-dichloro-2-oxo-2H-1-benzopyran-3-carboxylate
phenyl 6,8-dichloro-2-oxo-2H-1-benzopyran-3-carboxylate
Compound characteristics
| Compound ID: | 8002-7342 |
| Compound Name: | phenyl 6,8-dichloro-2-oxo-2H-1-benzopyran-3-carboxylate |
| Molecular Weight: | 335.14 |
| Molecular Formula: | C16 H8 Cl2 O4 |
| Smiles: | C1=C(C(=O)Oc2ccccc2)C(=O)Oc2c1cc(cc2[Cl])[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.4582 |
| logD: | 4.4582 |
| logSw: | -4.6121 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 41.222 |
| InChI Key: | BJTIUUZCEBRSJL-UHFFFAOYSA-N |