AC1ME8TC
2-(4-amino-3,5-dimethyl-1,2,4-triazol-4-ium-1-yl)-1-(2,4-dichlorophenyl)ethanone bromide
Also Known As: SR-01000211757-1|2-(4-amino-3,5-dimethyl-1,2,4-triazol-4-ium-1-yl)-1-(2,4-dichlorophenyl)ethanone bromide|4-Amino-1-[2-(2,4-dichloro-phenyl)-2-oxo-ethyl]-3,5-dimethyl-4H-[1,2,4]triazol-1-ium|4-amino-1-(2-(2,4-dichlorophenyl)-2-oxoethyl)-3,5-dimethyl-4H-1,2,4-triazol-1-ium bromide|4-amino-1-[2-(2,4-dichlorophenyl)-2-oxoethyl]-3,5-dimethyl-1H-1,2,4-triazol-4-ium bromide
| Molecular Formula | C12H13BrCl2N4O |
|---|---|
| Molecular Weight | 377.96497 g/mol |
| LogP | -1.30506 |
| Topological Polar Surface Area | 64.79 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 377.96497 |
| Monoisotopic Mass | 377.96497 |
| Heavy Atoms | 20 |
| Complexity | 657.14716 |
Chemical Identifiers
| CAS Number | 468093-07-4 |
|---|---|
| SMILES | CC1=NN(C(=[N+]1N)C)CC(=O)C2=C(C=C(C=C2)Cl)Cl.[Br-] |
Product Overview
AC1ME8TC (CAS 468093-07-4), with molecular formula C12H13BrCl2N4O and molecular weight 377.96497 g/mol. IUPAC: 2-(4-amino-3,5-dimethyl-1,2,4-triazol-4-ium-1-yl)-1-(2,4-dichlorophenyl)ethanone bromide.
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