3-ethoxy-1-(3-nitrophenyl)-3-oxopropyl 4-nitrobenzoate
Chemical Structure Depiction of
3-ethoxy-1-(3-nitrophenyl)-3-oxopropyl 4-nitrobenzoate
3-ethoxy-1-(3-nitrophenyl)-3-oxopropyl 4-nitrobenzoate
Compound characteristics
| Compound ID: | 0167-0159 |
| Compound Name: | 3-ethoxy-1-(3-nitrophenyl)-3-oxopropyl 4-nitrobenzoate |
| Molecular Weight: | 388.33 |
| Molecular Formula: | C18 H16 N2 O8 |
| Smiles: | CCOC(CC(c1cccc(c1)[N+]([O-])=O)OC(c1ccc(cc1)[N+]([O-])=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.7895 |
| logD: | 3.7895 |
| logSw: | -3.9887 |
| Hydrogen bond acceptors count: | 14 |
| Polar surface area: | 107.191 |
| InChI Key: | VAFMBLXQKMRHNS-INIZCTEOSA-N |