7-[(4-bromophenyl)methoxy]-6-chloro-3,4-dimethyl-2H-1-benzopyran-2-one
Chemical Structure Depiction of
7-[(4-bromophenyl)methoxy]-6-chloro-3,4-dimethyl-2H-1-benzopyran-2-one
7-[(4-bromophenyl)methoxy]-6-chloro-3,4-dimethyl-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | Y040-7613 |
| Compound Name: | 7-[(4-bromophenyl)methoxy]-6-chloro-3,4-dimethyl-2H-1-benzopyran-2-one |
| Molecular Weight: | 393.66 |
| Molecular Formula: | C18 H14 Br Cl O3 |
| Smiles: | CC1=C(C)c2cc(c(cc2OC1=O)OCc1ccc(cc1)[Br])[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.892 |
| logD: | 5.892 |
| logSw: | -6.0461 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 28.4743 |
| InChI Key: | VGVFUYMMRKKGIZ-UHFFFAOYSA-N |