4-chloro-N,N-bis(2-cyanoethyl)-2-nitrobenzamide
Chemical Structure Depiction of
4-chloro-N,N-bis(2-cyanoethyl)-2-nitrobenzamide
4-chloro-N,N-bis(2-cyanoethyl)-2-nitrobenzamide
Compound characteristics
| Compound ID: | Y032-3550 |
| Compound Name: | 4-chloro-N,N-bis(2-cyanoethyl)-2-nitrobenzamide |
| Molecular Weight: | 306.71 |
| Molecular Formula: | C13 H11 Cl N4 O3 |
| Smiles: | C(CN(CCC#N)C(c1ccc(cc1[N+]([O-])=O)[Cl])=O)C#N |
| Stereo: | ACHIRAL |
| logP: | 0.6251 |
| logD: | 0.6251 |
| logSw: | -2.6833 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 84.742 |
| InChI Key: | DDZPRRRICDYZHS-UHFFFAOYSA-N |