3-(3-methylphenoxy)-4-oxo-4H-1-benzopyran-7-yl 2-ethylbutanoate
Chemical Structure Depiction of
3-(3-methylphenoxy)-4-oxo-4H-1-benzopyran-7-yl 2-ethylbutanoate
3-(3-methylphenoxy)-4-oxo-4H-1-benzopyran-7-yl 2-ethylbutanoate
Compound characteristics
| Compound ID: | 4790-1374 |
| Compound Name: | 3-(3-methylphenoxy)-4-oxo-4H-1-benzopyran-7-yl 2-ethylbutanoate |
| Molecular Weight: | 366.41 |
| Molecular Formula: | C22 H22 O5 |
| Smiles: | CCC(CC)C(=O)Oc1ccc2C(C(=COc2c1)Oc1cccc(C)c1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0473 |
| logD: | 5.0473 |
| logSw: | -4.7287 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 48.219 |
| InChI Key: | CHBVCMVARBZIQF-UHFFFAOYSA-N |