4-chloro-3,5-dimethylphenyl 2-oxo-2H-1-benzopyran-3-carboxylate
Chemical Structure Depiction of
4-chloro-3,5-dimethylphenyl 2-oxo-2H-1-benzopyran-3-carboxylate
4-chloro-3,5-dimethylphenyl 2-oxo-2H-1-benzopyran-3-carboxylate
Compound characteristics
| Compound ID: | 3297-0827 |
| Compound Name: | 4-chloro-3,5-dimethylphenyl 2-oxo-2H-1-benzopyran-3-carboxylate |
| Molecular Weight: | 328.75 |
| Molecular Formula: | C18 H13 Cl O4 |
| Smiles: | Cc1cc(cc(C)c1[Cl])OC(C1=Cc2ccccc2OC1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6506 |
| logD: | 4.6506 |
| logSw: | -4.9676 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 41.538 |
| InChI Key: | GWPOGSWBUIZOJH-UHFFFAOYSA-N |