4-butyl-7-[2-(4-chlorophenyl)-2-oxoethoxy]-8-methyl-2H-1-benzopyran-2-one
Chemical Structure Depiction of
4-butyl-7-[2-(4-chlorophenyl)-2-oxoethoxy]-8-methyl-2H-1-benzopyran-2-one
4-butyl-7-[2-(4-chlorophenyl)-2-oxoethoxy]-8-methyl-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | Y040-2175 |
| Compound Name: | 4-butyl-7-[2-(4-chlorophenyl)-2-oxoethoxy]-8-methyl-2H-1-benzopyran-2-one |
| Molecular Weight: | 384.86 |
| Molecular Formula: | C22 H21 Cl O4 |
| Smiles: | CCCCC1=CC(=O)Oc2c1ccc(c2C)OCC(c1ccc(cc1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 5.4593 |
| logD: | 5.4593 |
| logSw: | -5.7831 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 40.891 |
| InChI Key: | MMCFKNSFCLOTQP-UHFFFAOYSA-N |