ethyl 2-[(3-ethyl-4-methyl-2-oxo-2H-1-benzopyran-7-yl)oxy]butanoate
Chemical Structure Depiction of
ethyl 2-[(3-ethyl-4-methyl-2-oxo-2H-1-benzopyran-7-yl)oxy]butanoate
ethyl 2-[(3-ethyl-4-methyl-2-oxo-2H-1-benzopyran-7-yl)oxy]butanoate
Compound characteristics
| Compound ID: | 6486-0010 |
| Compound Name: | ethyl 2-[(3-ethyl-4-methyl-2-oxo-2H-1-benzopyran-7-yl)oxy]butanoate |
| Molecular Weight: | 318.37 |
| Molecular Formula: | C18 H22 O5 |
| Smiles: | CCC(C(=O)OCC)Oc1ccc2C(C)=C(CC)C(=O)Oc2c1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.888 |
| logD: | 3.888 |
| logSw: | -4.0166 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 48.586 |
| InChI Key: | IGMGMSQQFZXJOW-HNNXBMFYSA-N |