N-tert-butyl-3-(3-nitrophenyl)prop-2-enamide
Chemical Structure Depiction of
N-tert-butyl-3-(3-nitrophenyl)prop-2-enamide
N-tert-butyl-3-(3-nitrophenyl)prop-2-enamide
Compound characteristics
| Compound ID: | Y500-6626 |
| Compound Name: | N-tert-butyl-3-(3-nitrophenyl)prop-2-enamide |
| Molecular Weight: | 248.28 |
| Molecular Formula: | C13 H16 N2 O3 |
| Smiles: | CC(C)(C)NC(/C=C/c1cccc(c1)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2778 |
| logD: | 3.2713 |
| logSw: | -3.4672 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.915 |
| InChI Key: | HPRSUGKFHXSQOD-UHFFFAOYSA-N |