2-hydroxy-N,N-dimethyl-N-[(4-nitrophenyl)methyl]ethan-1-aminium--chloride (1/1)
Chemical Structure Depiction of
2-hydroxy-N,N-dimethyl-N-[(4-nitrophenyl)methyl]ethan-1-aminium--chloride (1/1)
2-hydroxy-N,N-dimethyl-N-[(4-nitrophenyl)methyl]ethan-1-aminium--chloride (1/1)
Compound characteristics
| Compound ID: | 0110-0013 |
| Compound Name: | 2-hydroxy-N,N-dimethyl-N-[(4-nitrophenyl)methyl]ethan-1-aminium--chloride (1/1) |
| Molecular Weight: | 260.72 |
| Molecular Formula: | C11 H17 N2 O3 |
| Salt: | Cl- |
| Smiles: | C[N+](C)(CCO)Cc1ccc(cc1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 1.1958 |
| logD: | 1.1958 |
| logSw: | -1.789 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.611 |
| InChI Key: | SMAFWQYSFPBUIB-UHFFFAOYSA-N |