ethyl 3-[7-(2-tert-butoxy-2-oxoethoxy)-6-chloro-4-methyl-2-oxo-2H-1-benzopyran-3-yl]propanoate
Chemical Structure Depiction of
ethyl 3-[7-(2-tert-butoxy-2-oxoethoxy)-6-chloro-4-methyl-2-oxo-2H-1-benzopyran-3-yl]propanoate
ethyl 3-[7-(2-tert-butoxy-2-oxoethoxy)-6-chloro-4-methyl-2-oxo-2H-1-benzopyran-3-yl]propanoate
Compound characteristics
| Compound ID: | Y041-6537 |
| Compound Name: | ethyl 3-[7-(2-tert-butoxy-2-oxoethoxy)-6-chloro-4-methyl-2-oxo-2H-1-benzopyran-3-yl]propanoate |
| Molecular Weight: | 424.88 |
| Molecular Formula: | C21 H25 Cl O7 |
| Smiles: | CCOC(CCC1=C(C)c2cc(c(cc2OC1=O)OCC(=O)OC(C)(C)C)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 4.6977 |
| logD: | 4.6977 |
| logSw: | -4.8348 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 68.173 |
| InChI Key: | QQIUYLJAGSXPDA-UHFFFAOYSA-N |