3-benzyl-4-methyl-2-oxo-2H-1-benzopyran-7-yl acetate
Chemical Structure Depiction of
3-benzyl-4-methyl-2-oxo-2H-1-benzopyran-7-yl acetate
3-benzyl-4-methyl-2-oxo-2H-1-benzopyran-7-yl acetate
Compound characteristics
| Compound ID: | Y040-7754 |
| Compound Name: | 3-benzyl-4-methyl-2-oxo-2H-1-benzopyran-7-yl acetate |
| Molecular Weight: | 308.33 |
| Molecular Formula: | C19 H16 O4 |
| Smiles: | CC1=C(Cc2ccccc2)C(=O)Oc2cc(ccc12)OC(C)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4083 |
| logD: | 3.4083 |
| logSw: | -3.7717 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 41.64 |
| InChI Key: | LKJYNIPVEOPGKQ-UHFFFAOYSA-N |