3-(4-chlorophenoxy)-2-methyl-4-oxo-4H-1-benzopyran-7-yl acetate
Chemical Structure Depiction of
3-(4-chlorophenoxy)-2-methyl-4-oxo-4H-1-benzopyran-7-yl acetate
3-(4-chlorophenoxy)-2-methyl-4-oxo-4H-1-benzopyran-7-yl acetate
Compound characteristics
| Compound ID: | Y070-0105 |
| Compound Name: | 3-(4-chlorophenoxy)-2-methyl-4-oxo-4H-1-benzopyran-7-yl acetate |
| Molecular Weight: | 344.75 |
| Molecular Formula: | C18 H13 Cl O5 |
| Smiles: | CC1=C(C(c2ccc(cc2O1)OC(C)=O)=O)Oc1ccc(cc1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.658 |
| logD: | 3.658 |
| logSw: | -4.0087 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 48.414 |
| InChI Key: | RHILJJYQHLUIJZ-UHFFFAOYSA-N |