6-chloro-4-methyl-2-oxo-2H-1-benzopyran-7-yl 2,4-dichlorobenzoate
Chemical Structure Depiction of
6-chloro-4-methyl-2-oxo-2H-1-benzopyran-7-yl 2,4-dichlorobenzoate
6-chloro-4-methyl-2-oxo-2H-1-benzopyran-7-yl 2,4-dichlorobenzoate
Compound characteristics
| Compound ID: | Y040-0462 |
| Compound Name: | 6-chloro-4-methyl-2-oxo-2H-1-benzopyran-7-yl 2,4-dichlorobenzoate |
| Molecular Weight: | 383.61 |
| Molecular Formula: | C17 H9 Cl3 O4 |
| Smiles: | CC1=CC(=O)Oc2cc(c(cc12)[Cl])OC(c1ccc(cc1[Cl])[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 5.3166 |
| logD: | 5.3166 |
| logSw: | -6.1018 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 41.11 |
| InChI Key: | JFRSGXLSJMRIJQ-UHFFFAOYSA-N |