3,6-dichloro-4-methyl-7-[(3-methylphenyl)methoxy]-2H-1-benzopyran-2-one
Chemical Structure Depiction of
3,6-dichloro-4-methyl-7-[(3-methylphenyl)methoxy]-2H-1-benzopyran-2-one
3,6-dichloro-4-methyl-7-[(3-methylphenyl)methoxy]-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | Y040-0897 |
| Compound Name: | 3,6-dichloro-4-methyl-7-[(3-methylphenyl)methoxy]-2H-1-benzopyran-2-one |
| Molecular Weight: | 349.21 |
| Molecular Formula: | C18 H14 Cl2 O3 |
| Smiles: | CC1=C(C(=O)Oc2cc(c(cc12)[Cl])OCc1cccc(C)c1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.9068 |
| logD: | 5.9068 |
| logSw: | -6.0227 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 28.4743 |
| InChI Key: | SZWXKSDQAPOMRC-UHFFFAOYSA-N |