ethyl 2-acetyl-4,4-dicyano-3-phenylbutanoate
Chemical Structure Depiction of
ethyl 2-acetyl-4,4-dicyano-3-phenylbutanoate
ethyl 2-acetyl-4,4-dicyano-3-phenylbutanoate
Compound characteristics
| Compound ID: | 8002-4815 |
| Compound Name: | ethyl 2-acetyl-4,4-dicyano-3-phenylbutanoate |
| Molecular Weight: | 284.31 |
| Molecular Formula: | C16 H16 N2 O3 |
| Smiles: | CCOC(C(C(C(C#N)C#N)c1ccccc1)C(C)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 1.6388 |
| logD: | -1.3236 |
| logSw: | -1.8254 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 68.931 |
| InChI Key: | DWGAYAWCMRJTPV-UHFFFAOYSA-N |