4,8-dimethyl-2-oxo-2H-1-benzopyran-7-yl 2,4-dichlorobenzoate
Chemical Structure Depiction of
4,8-dimethyl-2-oxo-2H-1-benzopyran-7-yl 2,4-dichlorobenzoate
4,8-dimethyl-2-oxo-2H-1-benzopyran-7-yl 2,4-dichlorobenzoate
Compound characteristics
| Compound ID: | Y040-3726 |
| Compound Name: | 4,8-dimethyl-2-oxo-2H-1-benzopyran-7-yl 2,4-dichlorobenzoate |
| Molecular Weight: | 363.19 |
| Molecular Formula: | C18 H12 Cl2 O4 |
| Smiles: | CC1=CC(=O)Oc2c1ccc(c2C)OC(c1ccc(cc1[Cl])[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 5.1218 |
| logD: | 5.1218 |
| logSw: | -5.5738 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 40.794 |
| InChI Key: | LCSZHYVIVILMIK-UHFFFAOYSA-N |