6-chloro-7-[(3-methoxyphenyl)methoxy]-4-methyl-2H-1-benzopyran-2-one
Chemical Structure Depiction of
6-chloro-7-[(3-methoxyphenyl)methoxy]-4-methyl-2H-1-benzopyran-2-one
6-chloro-7-[(3-methoxyphenyl)methoxy]-4-methyl-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | Y040-0443 |
| Compound Name: | 6-chloro-7-[(3-methoxyphenyl)methoxy]-4-methyl-2H-1-benzopyran-2-one |
| Molecular Weight: | 330.77 |
| Molecular Formula: | C18 H15 Cl O4 |
| Smiles: | CC1=CC(=O)Oc2cc(c(cc12)[Cl])OCc1cccc(c1)OC |
| Stereo: | ACHIRAL |
| logP: | 4.5753 |
| logD: | 4.5753 |
| logSw: | -4.7874 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 35.504 |
| InChI Key: | KPLYHMNELPBEKM-UHFFFAOYSA-N |