7-[(4-bromophenyl)methoxy]-6-chloro-4-methyl-2H-1-benzopyran-2-one
Chemical Structure Depiction of
7-[(4-bromophenyl)methoxy]-6-chloro-4-methyl-2H-1-benzopyran-2-one
7-[(4-bromophenyl)methoxy]-6-chloro-4-methyl-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | Y040-0445 |
| Compound Name: | 7-[(4-bromophenyl)methoxy]-6-chloro-4-methyl-2H-1-benzopyran-2-one |
| Molecular Weight: | 379.64 |
| Molecular Formula: | C17 H12 Br Cl O3 |
| Smiles: | CC1=CC(=O)Oc2cc(c(cc12)[Cl])OCc1ccc(cc1)[Br] |
| Stereo: | ACHIRAL |
| logP: | 5.3039 |
| logD: | 5.3039 |
| logSw: | -5.9204 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 27.9599 |
| InChI Key: | OIRIKKGOQHBGSC-UHFFFAOYSA-N |