2-[4-(4-chloro-2-nitrophenoxy)phenyl]-2-oxoethyl 9H-xanthene-9-carboxylate
Chemical Structure Depiction of
2-[4-(4-chloro-2-nitrophenoxy)phenyl]-2-oxoethyl 9H-xanthene-9-carboxylate
2-[4-(4-chloro-2-nitrophenoxy)phenyl]-2-oxoethyl 9H-xanthene-9-carboxylate
Compound characteristics
| Compound ID: | 3796-0495 |
| Compound Name: | 2-[4-(4-chloro-2-nitrophenoxy)phenyl]-2-oxoethyl 9H-xanthene-9-carboxylate |
| Molecular Weight: | 515.91 |
| Molecular Formula: | C28 H18 Cl N O7 |
| Smiles: | C(C(c1ccc(cc1)Oc1ccc(cc1[N+]([O-])=O)[Cl])=O)OC(C1c2ccccc2Oc2ccccc12)=O |
| Stereo: | ACHIRAL |
| logP: | 5.7574 |
| logD: | -0.7176 |
| logSw: | -6.0989 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 81.072 |
| InChI Key: | HFAVNMHNMXHBLG-UHFFFAOYSA-N |