4-butyl-2-oxo-2H-1-benzopyran-7-yl 2,4-dichlorobenzoate
Chemical Structure Depiction of
4-butyl-2-oxo-2H-1-benzopyran-7-yl 2,4-dichlorobenzoate
4-butyl-2-oxo-2H-1-benzopyran-7-yl 2,4-dichlorobenzoate
Compound characteristics
| Compound ID: | Y040-7809 |
| Compound Name: | 4-butyl-2-oxo-2H-1-benzopyran-7-yl 2,4-dichlorobenzoate |
| Molecular Weight: | 391.25 |
| Molecular Formula: | C20 H16 Cl2 O4 |
| Smiles: | CCCCC1=CC(=O)Oc2cc(ccc12)OC(c1ccc(cc1[Cl])[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 5.9219 |
| logD: | 5.9219 |
| logSw: | -6.093 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 41.023 |
| InChI Key: | IAXOGZVWQONXQL-UHFFFAOYSA-N |