8-acetyl-3-butyl-7-[(4-chlorophenyl)methoxy]-4-methyl-2H-1-benzopyran-2-one
Chemical Structure Depiction of
8-acetyl-3-butyl-7-[(4-chlorophenyl)methoxy]-4-methyl-2H-1-benzopyran-2-one
8-acetyl-3-butyl-7-[(4-chlorophenyl)methoxy]-4-methyl-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | 4579-0176 |
| Compound Name: | 8-acetyl-3-butyl-7-[(4-chlorophenyl)methoxy]-4-methyl-2H-1-benzopyran-2-one |
| Molecular Weight: | 398.89 |
| Molecular Formula: | C23 H23 Cl O4 |
| Smiles: | CCCCC1=C(C)c2ccc(c(C(C)=O)c2OC1=O)OCc1ccc(cc1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 6.0755 |
| logD: | 6.0755 |
| logSw: | -6.1126 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 41.985 |
| InChI Key: | MTFGRXUEUNVBTA-UHFFFAOYSA-N |