tert-butyl [(6-chloro-4-ethyl-2-oxo-2H-1-benzopyran-7-yl)oxy]acetate
Chemical Structure Depiction of
tert-butyl [(6-chloro-4-ethyl-2-oxo-2H-1-benzopyran-7-yl)oxy]acetate
tert-butyl [(6-chloro-4-ethyl-2-oxo-2H-1-benzopyran-7-yl)oxy]acetate
Compound characteristics
| Compound ID: | Y040-2083 |
| Compound Name: | tert-butyl [(6-chloro-4-ethyl-2-oxo-2H-1-benzopyran-7-yl)oxy]acetate |
| Molecular Weight: | 338.79 |
| Molecular Formula: | C17 H19 Cl O5 |
| Smiles: | CCC1=CC(=O)Oc2cc(c(cc12)[Cl])OCC(=O)OC(C)(C)C |
| Stereo: | ACHIRAL |
| logP: | 4.149 |
| logD: | 4.149 |
| logSw: | -4.4435 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 47.5 |
| InChI Key: | FMTZCYKJZAIYKM-UHFFFAOYSA-N |