AC1MHJ0V
1-(2,6-dimethylphenyl)-3-[N'-(2,2,2-trifluoroethyl)carbamimidoyl]urea;hydrochloride
Also Known As: Urea, N-(2,6-dimethylphenyl)-N'-(imino((2,2,2-trifluoroethyl)amino)methyl)-, monohydrochloride|Urea, 1-(2,2,2-trifluoroethyl)amidino-3-(2,6-xylyl)-, hydrochloride|1-(2,2,2-Trifluoroethyl)amidino-3-(2,6-xylyl)-urea hydrochloride|1-(2,6-dimethylphenyl)-3-[N'-(2,2,2-trifluoroethyl)carbamimidoyl]urea hydrochloride|1-(2,6-dimethylphenylcarbamoyl)-3-(2,2,2-trifluoroethyl) guanidine hydrochloride|N-(2,6-Dimethylphenyl)-N'-[N'-(2,2,2-trifluoroethyl)carbamimidoyl]urea--hydrogen chloride (1/1)
| Molecular Formula | C12H16ClF3N4O |
|---|---|
| Molecular Weight | 324.09647 g/mol |
| LogP | 2.72374 |
| Topological Polar Surface Area | 79.51 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 324.09647 |
| Monoisotopic Mass | 324.09647 |
| Heavy Atoms | 21 |
| Complexity | 511.4741 |
Chemical Identifiers
| CAS Number | 68656-84-8 |
|---|---|
| SMILES | CC1=C(C(=CC=C1)C)NC(=O)NC(=NCC(F)(F)F)N.Cl |
Product Overview
AC1MHJ0V (CAS 68656-84-8), with molecular formula C12H16ClF3N4O and molecular weight 324.09647 g/mol. IUPAC: 1-(2,6-dimethylphenyl)-3-[N'-(2,2,2-trifluoroethyl)carbamimidoyl]urea;hydrochloride.