2-(3,4-dichlorophenyl)-2-oxoethyl 2-oxo-2H-1-benzopyran-3-carboxylate
Chemical Structure Depiction of
2-(3,4-dichlorophenyl)-2-oxoethyl 2-oxo-2H-1-benzopyran-3-carboxylate
2-(3,4-dichlorophenyl)-2-oxoethyl 2-oxo-2H-1-benzopyran-3-carboxylate
Compound characteristics
| Compound ID: | 8005-0402 |
| Compound Name: | 2-(3,4-dichlorophenyl)-2-oxoethyl 2-oxo-2H-1-benzopyran-3-carboxylate |
| Molecular Weight: | 377.18 |
| Molecular Formula: | C18 H10 Cl2 O5 |
| Smiles: | C(C(c1ccc(c(c1)[Cl])[Cl])=O)OC(C1=Cc2ccccc2OC1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1394 |
| logD: | 4.1394 |
| logSw: | -4.5154 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 55.265 |
| InChI Key: | CRNGTJUXTSDCDI-UHFFFAOYSA-N |