1-[3-(2,2-dichloroacetamido)propyl]-3-methyl-1H-imidazol-3-ium--iodide (1/1)
Chemical Structure Depiction of
1-[3-(2,2-dichloroacetamido)propyl]-3-methyl-1H-imidazol-3-ium--iodide (1/1)
1-[3-(2,2-dichloroacetamido)propyl]-3-methyl-1H-imidazol-3-ium--iodide (1/1)
Compound characteristics
| Compound ID: | 5556-0108 |
| Compound Name: | 1-[3-(2,2-dichloroacetamido)propyl]-3-methyl-1H-imidazol-3-ium--iodide (1/1) |
| Molecular Weight: | 378.04 |
| Molecular Formula: | C9 H14 Cl2 N3 O |
| Salt: | I- |
| Smiles: | C[n+]1ccn(CCCNC(C([Cl])[Cl])=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 0.3797 |
| logD: | 0.3797 |
| logSw: | -1.2082 |
| Hydrogen bond acceptors count: | 2 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 32.155 |
| InChI Key: | AHVZJTLSRMRPCE-UHFFFAOYSA-O |