8-methyl-2-oxo-4-propyl-2H-1-benzopyran-7-yl 4-methylbenzoate
Chemical Structure Depiction of
8-methyl-2-oxo-4-propyl-2H-1-benzopyran-7-yl 4-methylbenzoate
8-methyl-2-oxo-4-propyl-2H-1-benzopyran-7-yl 4-methylbenzoate
Compound characteristics
| Compound ID: | Y040-3955 |
| Compound Name: | 8-methyl-2-oxo-4-propyl-2H-1-benzopyran-7-yl 4-methylbenzoate |
| Molecular Weight: | 336.39 |
| Molecular Formula: | C21 H20 O4 |
| Smiles: | CCCC1=CC(=O)Oc2c1ccc(c2C)OC(c1ccc(C)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.014 |
| logD: | 5.014 |
| logSw: | -4.6881 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 40.794 |
| InChI Key: | LTGGVWMJUSLISH-UHFFFAOYSA-N |