4-chloro-2-nitro-N-(2,4,4-trimethylpentan-2-yl)benzamide
Chemical Structure Depiction of
4-chloro-2-nitro-N-(2,4,4-trimethylpentan-2-yl)benzamide
4-chloro-2-nitro-N-(2,4,4-trimethylpentan-2-yl)benzamide
Compound characteristics
| Compound ID: | Y032-3682 |
| Compound Name: | 4-chloro-2-nitro-N-(2,4,4-trimethylpentan-2-yl)benzamide |
| Molecular Weight: | 312.79 |
| Molecular Formula: | C15 H21 Cl N2 O3 |
| Smiles: | CC(C)(C)CC(C)(C)NC(c1ccc(cc1[N+]([O-])=O)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 4.3227 |
| logD: | 4.3053 |
| logSw: | -4.6165 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.295 |
| InChI Key: | CTIAIQPJUWQJJD-UHFFFAOYSA-N |