N-benzyl-N,N-diethylethanaminium--4-nitrophenolate (1/1)
Chemical Structure Depiction of
N-benzyl-N,N-diethylethanaminium--4-nitrophenolate (1/1)
N-benzyl-N,N-diethylethanaminium--4-nitrophenolate (1/1)
Compound characteristics
| Compound ID: | 0598-0007 |
| Compound Name: | N-benzyl-N,N-diethylethanaminium--4-nitrophenolate (1/1) |
| Molecular Weight: | 330.42 |
| Molecular Formula: | C6 H4 N O3 |
| Salt: | C6H5CH2N(C2H5)3+ |
| Smiles: | c1cc(ccc1[N+]([O-])=O)[O-] |
| Stereo: | ACHIRAL |
| logP: | 1.4957 |
| logD: | 1.4957 |
| logSw: | -1.2087 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 51.237 |
| InChI Key: | BTJIUGUIPKRLHP-UHFFFAOYSA-M |