3-(4-chlorophenyl)-7-(2-oxopropoxy)-2H-1-benzopyran-2-one
Chemical Structure Depiction of
3-(4-chlorophenyl)-7-(2-oxopropoxy)-2H-1-benzopyran-2-one
3-(4-chlorophenyl)-7-(2-oxopropoxy)-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | Y040-3401 |
| Compound Name: | 3-(4-chlorophenyl)-7-(2-oxopropoxy)-2H-1-benzopyran-2-one |
| Molecular Weight: | 328.75 |
| Molecular Formula: | C18 H13 Cl O4 |
| Smiles: | CC(COc1ccc2C=C(C(=O)Oc2c1)c1ccc(cc1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 3.2732 |
| logD: | 3.2732 |
| logSw: | -3.7268 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 41.723 |
| InChI Key: | LKKHINZWIAAMMU-UHFFFAOYSA-N |