2-methyl-N-(3-methylbutyl)-3-nitrobenzamide
Chemical Structure Depiction of
2-methyl-N-(3-methylbutyl)-3-nitrobenzamide
2-methyl-N-(3-methylbutyl)-3-nitrobenzamide
Compound characteristics
| Compound ID: | Y032-0789 |
| Compound Name: | 2-methyl-N-(3-methylbutyl)-3-nitrobenzamide |
| Molecular Weight: | 250.3 |
| Molecular Formula: | C13 H18 N2 O3 |
| Smiles: | CC(C)CCNC(c1cccc(c1C)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2519 |
| logD: | 3.2518 |
| logSw: | -3.8979 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.845 |
| InChI Key: | LZAPDVPNTSDJKR-UHFFFAOYSA-N |