N-(4-chloro-3-nitrophenyl)-3-methylbutanamide
Chemical Structure Depiction of
N-(4-chloro-3-nitrophenyl)-3-methylbutanamide
N-(4-chloro-3-nitrophenyl)-3-methylbutanamide
Compound characteristics
| Compound ID: | Y032-0874 |
| Compound Name: | N-(4-chloro-3-nitrophenyl)-3-methylbutanamide |
| Molecular Weight: | 256.69 |
| Molecular Formula: | C11 H13 Cl N2 O3 |
| Smiles: | CC(C)CC(Nc1ccc(c(c1)[N+]([O-])=O)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 3.0938 |
| logD: | 2.9767 |
| logSw: | -3.559 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.468 |
| InChI Key: | ATCGJYDOZZZASO-UHFFFAOYSA-N |