N-benzyl-N,N-diethylethanaminium--2,5-dinitrophenolate (1/1)
Chemical Structure Depiction of
N-benzyl-N,N-diethylethanaminium--2,5-dinitrophenolate (1/1)
N-benzyl-N,N-diethylethanaminium--2,5-dinitrophenolate (1/1)
Compound characteristics
| Compound ID: | 0598-0010 |
| Compound Name: | N-benzyl-N,N-diethylethanaminium--2,5-dinitrophenolate (1/1) |
| Molecular Weight: | 375.42 |
| Molecular Formula: | C6 H3 N2 O5 |
| Salt: | C6H5CH2N(C2H5)3+ |
| Smiles: | c1cc(c(cc1[N+]([O-])=O)[O-])[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 1.6113 |
| logD: | 1.6113 |
| logSw: | -1.7176 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 83.249 |
| InChI Key: | UWEZBKLLMKVIPI-UHFFFAOYSA-M |