methyl 2-[(6-chloro-4-ethyl-2-oxo-2H-1-benzopyran-7-yl)oxy]propanoate
Chemical Structure Depiction of
methyl 2-[(6-chloro-4-ethyl-2-oxo-2H-1-benzopyran-7-yl)oxy]propanoate
methyl 2-[(6-chloro-4-ethyl-2-oxo-2H-1-benzopyran-7-yl)oxy]propanoate
Compound characteristics
| Compound ID: | Y040-0298 |
| Compound Name: | methyl 2-[(6-chloro-4-ethyl-2-oxo-2H-1-benzopyran-7-yl)oxy]propanoate |
| Molecular Weight: | 310.73 |
| Molecular Formula: | C15 H15 Cl O5 |
| Smiles: | CCC1=CC(=O)Oc2cc(c(cc12)[Cl])OC(C)C(=O)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.471 |
| logD: | 3.471 |
| logSw: | -3.6998 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 48.695 |
| InChI Key: | JGJCHLIMEIMQPD-QMMMGPOBSA-N |