3-benzyl-4-methyl-7-[(2-methylprop-2-en-1-yl)oxy]-2H-1-benzopyran-2-one
Chemical Structure Depiction of
3-benzyl-4-methyl-7-[(2-methylprop-2-en-1-yl)oxy]-2H-1-benzopyran-2-one
3-benzyl-4-methyl-7-[(2-methylprop-2-en-1-yl)oxy]-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | Y042-9414 |
| Compound Name: | 3-benzyl-4-methyl-7-[(2-methylprop-2-en-1-yl)oxy]-2H-1-benzopyran-2-one |
| Molecular Weight: | 320.39 |
| Molecular Formula: | C21 H20 O3 |
| Smiles: | CC(=C)COc1ccc2C(C)=C(Cc3ccccc3)C(=O)Oc2c1 |
| Stereo: | ACHIRAL |
| logP: | 5.0384 |
| logD: | 5.0384 |
| logSw: | -4.8948 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 28.3876 |
| InChI Key: | NCKNPWJOYSEFBD-UHFFFAOYSA-N |