Nigragilline, tetrahydro-
1-[(2S,5R)-2,4,5-trimethylpiperazin-1-yl]hexan-1-one
Also Known As: Tetrahydronigragillin|Nigragilline, tetrahydro-|1-[(2S,5R)-2,4,5-trimethylpiperazin-1-yl]hexan-1-one
CAS: 24779-41-7
| Molecular Formula | C13H26N2O |
|---|---|
| Molecular Weight | 226.20451 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 23.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 226.20451 |
| Monoisotopic Mass | 226.20451 |
| Heavy Atoms | 16 |
| Complexity | 230.0 |
Chemical Identifiers
| CAS Number | 24779-41-7 |
|---|---|
| SMILES | CCCCCC(=O)N1C[C@H](N(C[C@@H]1C)C)C |
| InChIKey | QSVVIHKUSYIAGZ-NEPJUHHUSA-N |
Product Overview
Nigragilline, tetrahydro- (CAS 24779-41-7), with molecular formula C13H26N2O and molecular weight 226.20451 g/mol. IUPAC: 1-[(2S,5R)-2,4,5-trimethylpiperazin-1-yl]hexan-1-one.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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