3-hexyl-4,8-dimethyl-2-oxo-2H-1-benzopyran-7-yl 4-methoxybenzoate
Chemical Structure Depiction of
3-hexyl-4,8-dimethyl-2-oxo-2H-1-benzopyran-7-yl 4-methoxybenzoate
3-hexyl-4,8-dimethyl-2-oxo-2H-1-benzopyran-7-yl 4-methoxybenzoate
Compound characteristics
| Compound ID: | Y041-3007 |
| Compound Name: | 3-hexyl-4,8-dimethyl-2-oxo-2H-1-benzopyran-7-yl 4-methoxybenzoate |
| Molecular Weight: | 408.49 |
| Molecular Formula: | C25 H28 O5 |
| Smiles: | CCCCCCC1=C(C)c2ccc(c(C)c2OC1=O)OC(c1ccc(cc1)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 6.7781 |
| logD: | 6.7781 |
| logSw: | -5.7592 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 48.853 |
| InChI Key: | RFPQAWZBNZNOIH-UHFFFAOYSA-N |