butan-2-yl {[3-(3-methylphenoxy)-4-oxo-4H-1-benzopyran-7-yl]oxy}acetate
Chemical Structure Depiction of
butan-2-yl {[3-(3-methylphenoxy)-4-oxo-4H-1-benzopyran-7-yl]oxy}acetate
butan-2-yl {[3-(3-methylphenoxy)-4-oxo-4H-1-benzopyran-7-yl]oxy}acetate
Compound characteristics
| Compound ID: | 5976-1659 |
| Compound Name: | butan-2-yl {[3-(3-methylphenoxy)-4-oxo-4H-1-benzopyran-7-yl]oxy}acetate |
| Molecular Weight: | 382.41 |
| Molecular Formula: | C22 H22 O6 |
| Smiles: | CCC(C)OC(COc1ccc2C(C(=COc2c1)Oc1cccc(C)c1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.2372 |
| logD: | 4.2372 |
| logSw: | -4.4306 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 54.79 |
| InChI Key: | RFQUKHQWYGXBKO-HNNXBMFYSA-N |