6-chloro-4-ethyl-7-[(4-methylphenyl)methoxy]-2H-1-benzopyran-2-one
Chemical Structure Depiction of
6-chloro-4-ethyl-7-[(4-methylphenyl)methoxy]-2H-1-benzopyran-2-one
6-chloro-4-ethyl-7-[(4-methylphenyl)methoxy]-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | Y040-2104 |
| Compound Name: | 6-chloro-4-ethyl-7-[(4-methylphenyl)methoxy]-2H-1-benzopyran-2-one |
| Molecular Weight: | 328.79 |
| Molecular Formula: | C19 H17 Cl O3 |
| Smiles: | CCC1=CC(=O)Oc2cc(c(cc12)[Cl])OCc1ccc(C)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.3222 |
| logD: | 5.3222 |
| logSw: | -5.9696 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 27.9599 |
| InChI Key: | LQVAFRHDNPCTGL-UHFFFAOYSA-N |