2-cyano-5-(ethylamino)-4-nitropenta-2,4-dienoic acid
Chemical Structure Depiction of
2-cyano-5-(ethylamino)-4-nitropenta-2,4-dienoic acid
2-cyano-5-(ethylamino)-4-nitropenta-2,4-dienoic acid
Compound characteristics
| Compound ID: | 8018-9468 |
| Compound Name: | 2-cyano-5-(ethylamino)-4-nitropenta-2,4-dienoic acid |
| Molecular Weight: | 211.17 |
| Molecular Formula: | C8 H9 N3 O4 |
| Smiles: | CCN/C=C(/C=C(\C#N)C(O)=O)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | -0.454 |
| logD: | -8.1761 |
| logSw: | -1.1226 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 90.955 |
| InChI Key: | IPPAGQJAHUIKOG-UHFFFAOYSA-N |