ethyl 5,5-dimethyl-2-[2-(3-nitrobenzoyl)hydrazinylidene]-4-oxohexanoate
Chemical Structure Depiction of
ethyl 5,5-dimethyl-2-[2-(3-nitrobenzoyl)hydrazinylidene]-4-oxohexanoate
ethyl 5,5-dimethyl-2-[2-(3-nitrobenzoyl)hydrazinylidene]-4-oxohexanoate
Compound characteristics
| Compound ID: | 8007-6900 |
| Compound Name: | ethyl 5,5-dimethyl-2-[2-(3-nitrobenzoyl)hydrazinylidene]-4-oxohexanoate |
| Molecular Weight: | 363.37 |
| Molecular Formula: | C17 H21 N3 O6 |
| Smiles: | CCOC(C(/CC(C(C)(C)C)=O)=N/NC(c1cccc(c1)[N+]([O-])=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8646 |
| logD: | -0.2702 |
| logSw: | -3.3791 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 102.807 |
| InChI Key: | OZLATQMMLMNFMU-UHFFFAOYSA-N |