1-methyl-3-(2-oxo-2-phenylethyl)-1H-imidazol-3-ium--bromide (1/1)
Chemical Structure Depiction of
1-methyl-3-(2-oxo-2-phenylethyl)-1H-imidazol-3-ium--bromide (1/1)
1-methyl-3-(2-oxo-2-phenylethyl)-1H-imidazol-3-ium--bromide (1/1)
Compound characteristics
Compound ID: | 1512-0210 |
Compound Name: | 1-methyl-3-(2-oxo-2-phenylethyl)-1H-imidazol-3-ium--bromide (1/1) |
Molecular Weight: | 281.15 |
Molecular Formula: | C12 H13 N2 O |
Salt: | Br- |
Smiles: | Cn1cc[n+](CC(c2ccccc2)=O)c1 |
Stereo: | ACHIRAL |
logP: | 1.0491 |
logD: | 1.0491 |
logSw: | -1.8122 |
Hydrogen bond acceptors count: | 2 |
Polar surface area: | 20.6256 |
InChI Key: | YDOLSEINKBVALM-UHFFFAOYSA-N |