7-[(4-bromophenyl)methoxy]-3,4-dimethyl-2H-1-benzopyran-2-one
Chemical Structure Depiction of
7-[(4-bromophenyl)methoxy]-3,4-dimethyl-2H-1-benzopyran-2-one
7-[(4-bromophenyl)methoxy]-3,4-dimethyl-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | Y040-1775 |
| Compound Name: | 7-[(4-bromophenyl)methoxy]-3,4-dimethyl-2H-1-benzopyran-2-one |
| Molecular Weight: | 359.22 |
| Molecular Formula: | C18 H15 Br O3 |
| Smiles: | CC1=C(C)c2ccc(cc2OC1=O)OCc1ccc(cc1)[Br] |
| Stereo: | ACHIRAL |
| logP: | 4.8259 |
| logD: | 4.8259 |
| logSw: | -4.8865 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 28.3876 |
| InChI Key: | BQKNTORLFILRDH-UHFFFAOYSA-N |