7-[(4-chlorophenyl)methoxy]-4-methyl-3-(3-methylbutyl)-2H-1-benzopyran-2-one
Chemical Structure Depiction of
7-[(4-chlorophenyl)methoxy]-4-methyl-3-(3-methylbutyl)-2H-1-benzopyran-2-one
7-[(4-chlorophenyl)methoxy]-4-methyl-3-(3-methylbutyl)-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | D060-0111 |
| Compound Name: | 7-[(4-chlorophenyl)methoxy]-4-methyl-3-(3-methylbutyl)-2H-1-benzopyran-2-one |
| Molecular Weight: | 370.87 |
| Molecular Formula: | C22 H23 Cl O3 |
| Smiles: | CC(C)CCC1=C(C)c2ccc(cc2OC1=O)OCc1ccc(cc1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 6.281 |
| logD: | 6.281 |
| logSw: | -6.1546 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 28.3876 |
| InChI Key: | OFGKIYJQOMRRED-UHFFFAOYSA-N |