N,N-bis(cyanomethyl)-3-methyl-4-nitrobenzamide
Chemical Structure Depiction of
N,N-bis(cyanomethyl)-3-methyl-4-nitrobenzamide
N,N-bis(cyanomethyl)-3-methyl-4-nitrobenzamide
Compound characteristics
| Compound ID: | Y031-9785 |
| Compound Name: | N,N-bis(cyanomethyl)-3-methyl-4-nitrobenzamide |
| Molecular Weight: | 258.23 |
| Molecular Formula: | C12 H10 N4 O3 |
| Smiles: | Cc1cc(ccc1[N+]([O-])=O)C(N(CC#N)CC#N)=O |
| Stereo: | ACHIRAL |
| logP: | 0.7467 |
| logD: | 0.7467 |
| logSw: | -1.7922 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 84.742 |
| InChI Key: | SISYNQLXJQLJIJ-UHFFFAOYSA-N |