butan-2-yl {[3-(4-tert-butylphenoxy)-4-oxo-4H-1-benzopyran-7-yl]oxy}acetate
Chemical Structure Depiction of
butan-2-yl {[3-(4-tert-butylphenoxy)-4-oxo-4H-1-benzopyran-7-yl]oxy}acetate
butan-2-yl {[3-(4-tert-butylphenoxy)-4-oxo-4H-1-benzopyran-7-yl]oxy}acetate
Compound characteristics
| Compound ID: | 5976-1653 |
| Compound Name: | butan-2-yl {[3-(4-tert-butylphenoxy)-4-oxo-4H-1-benzopyran-7-yl]oxy}acetate |
| Molecular Weight: | 424.49 |
| Molecular Formula: | C25 H28 O6 |
| Smiles: | CCC(C)OC(COc1ccc2C(C(=COc2c1)Oc1ccc(cc1)C(C)(C)C)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.6264 |
| logD: | 5.6264 |
| logSw: | -5.4847 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 54.79 |
| InChI Key: | JMJQZSJOBVPLRY-INIZCTEOSA-N |