3-methylbutyl {[3-(4-methoxyphenoxy)-4-oxo-4H-1-benzopyran-7-yl]oxy}acetate
Chemical Structure Depiction of
3-methylbutyl {[3-(4-methoxyphenoxy)-4-oxo-4H-1-benzopyran-7-yl]oxy}acetate
3-methylbutyl {[3-(4-methoxyphenoxy)-4-oxo-4H-1-benzopyran-7-yl]oxy}acetate
Compound characteristics
| Compound ID: | 3793-3237 |
| Compound Name: | 3-methylbutyl {[3-(4-methoxyphenoxy)-4-oxo-4H-1-benzopyran-7-yl]oxy}acetate |
| Molecular Weight: | 412.44 |
| Molecular Formula: | C23 H24 O7 |
| Smiles: | CC(C)CCOC(COc1ccc2C(C(=COc2c1)Oc1ccc(cc1)OC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0447 |
| logD: | 4.0447 |
| logSw: | -4.2648 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 63.066 |
| InChI Key: | NUXARCBXYMZGQK-UHFFFAOYSA-N |