2-methylpropyl {[3-(3-methylphenoxy)-4-oxo-4H-1-benzopyran-7-yl]oxy}acetate
Chemical Structure Depiction of
2-methylpropyl {[3-(3-methylphenoxy)-4-oxo-4H-1-benzopyran-7-yl]oxy}acetate
2-methylpropyl {[3-(3-methylphenoxy)-4-oxo-4H-1-benzopyran-7-yl]oxy}acetate
Compound characteristics
| Compound ID: | 3793-3022 |
| Compound Name: | 2-methylpropyl {[3-(3-methylphenoxy)-4-oxo-4H-1-benzopyran-7-yl]oxy}acetate |
| Molecular Weight: | 382.41 |
| Molecular Formula: | C22 H22 O6 |
| Smiles: | CC(C)COC(COc1ccc2C(C(=COc2c1)Oc1cccc(C)c1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2424 |
| logD: | 4.2424 |
| logSw: | -4.5149 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 55.603 |
| InChI Key: | CDDWIRVWGAWIOJ-UHFFFAOYSA-N |