methyl [(3,6-dichloro-4-methyl-2-oxo-2H-1-benzopyran-7-yl)oxy]acetate
Chemical Structure Depiction of
methyl [(3,6-dichloro-4-methyl-2-oxo-2H-1-benzopyran-7-yl)oxy]acetate
methyl [(3,6-dichloro-4-methyl-2-oxo-2H-1-benzopyran-7-yl)oxy]acetate
Compound characteristics
| Compound ID: | Y040-0894 |
| Compound Name: | methyl [(3,6-dichloro-4-methyl-2-oxo-2H-1-benzopyran-7-yl)oxy]acetate |
| Molecular Weight: | 317.12 |
| Molecular Formula: | C13 H10 Cl2 O5 |
| Smiles: | CC1=C(C(=O)Oc2cc(c(cc12)[Cl])OCC(=O)OC)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.0453 |
| logD: | 3.0453 |
| logSw: | -3.3418 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 49.325 |
| InChI Key: | HZPVTVDBZZIAGX-UHFFFAOYSA-N |