6-chloro-4-ethyl-7-(2-oxopropoxy)-2H-1-benzopyran-2-one
Chemical Structure Depiction of
6-chloro-4-ethyl-7-(2-oxopropoxy)-2H-1-benzopyran-2-one
6-chloro-4-ethyl-7-(2-oxopropoxy)-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | Y040-0243 |
| Compound Name: | 6-chloro-4-ethyl-7-(2-oxopropoxy)-2H-1-benzopyran-2-one |
| Molecular Weight: | 280.71 |
| Molecular Formula: | C14 H13 Cl O4 |
| Smiles: | CCC1=CC(=O)Oc2cc(c(cc12)[Cl])OCC(C)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7304 |
| logD: | 2.7304 |
| logSw: | -3.4021 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 41.567 |
| InChI Key: | OFEMCKJZOPYCOT-UHFFFAOYSA-N |