ethyl 3-{6-chloro-4-methyl-2-oxo-7-[(propan-2-yl)oxy]-2H-1-benzopyran-3-yl}propanoate
Chemical Structure Depiction of
ethyl 3-{6-chloro-4-methyl-2-oxo-7-[(propan-2-yl)oxy]-2H-1-benzopyran-3-yl}propanoate
ethyl 3-{6-chloro-4-methyl-2-oxo-7-[(propan-2-yl)oxy]-2H-1-benzopyran-3-yl}propanoate
Compound characteristics
| Compound ID: | Y040-2263 |
| Compound Name: | ethyl 3-{6-chloro-4-methyl-2-oxo-7-[(propan-2-yl)oxy]-2H-1-benzopyran-3-yl}propanoate |
| Molecular Weight: | 352.81 |
| Molecular Formula: | C18 H21 Cl O5 |
| Smiles: | CCOC(CCC1=C(C)c2cc(c(cc2OC1=O)OC(C)C)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 4.6118 |
| logD: | 4.6118 |
| logSw: | -4.8509 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 48.208 |
| InChI Key: | JGTADONQVHZCOE-UHFFFAOYSA-N |