4-chloro-N,N-bis(cyanomethyl)-3-nitrobenzamide
Chemical Structure Depiction of
4-chloro-N,N-bis(cyanomethyl)-3-nitrobenzamide
4-chloro-N,N-bis(cyanomethyl)-3-nitrobenzamide
Compound characteristics
| Compound ID: | Y031-8290 |
| Compound Name: | 4-chloro-N,N-bis(cyanomethyl)-3-nitrobenzamide |
| Molecular Weight: | 278.65 |
| Molecular Formula: | C11 H7 Cl N4 O3 |
| Smiles: | C(C#N)N(CC#N)C(c1ccc(c(c1)[N+]([O-])=O)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 0.5436 |
| logD: | 0.5436 |
| logSw: | -2.5069 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 84.742 |
| InChI Key: | PFWOUDOKRDXWME-UHFFFAOYSA-N |