trimethyl-[[(2S,5S)-5-methyl-4-oxooxolan-2-yl]methyl]azanium
trimethyl-[[(2S,5S)-5-methyl-4-oxooxolan-2-yl]methyl]azanium
Also Known As: Muscarone|Allomuscarone|3-Deoxy-3-oxomuscarine|trimethyl-[[(2S,5S)-5-methyl-4-oxooxolan-2-yl]methyl]azanium|(2S,5S)-Tetrahydro-4-oxo-5,N,N,N-tetramethyl-2-furanmethanaminium|(2S,5S)-Tetrahydro-N,N,N,5-tetramethyl-4-oxo-2-furanmethanaminium|trimethyl-[[(2S,5S)-5-methyl-4-oxo-oxolan-2-yl]methyl]azanium|2-Furanmethanaminium, tetrahydro-N,N,N,5-tetramethyl-4-oxo-, (2S-cis)-|2-Furanmethanaminium, tetrahydro-N,N,N,5-tetramethyl-4-oxo-, cis-(+-)-|Tetrahydro-N,N,N,5-tetramethyl-4-oxo-2-furanmethanaminium (2S-cis)-|TRIMETHYL({[(2S,5S)-5-METHYL-4-OXOOXOLAN-2-YL]METHYL})AZANIUM|Trimethyl-(5-methyl-4-oxo-tetrahydro-furan-2-ylmethyl)-ammonium; iodide|(-)-alpha-[[(2S)-Tetrahydro-5alpha-methyl-4-oxofuran]-2alpha-yl]-N,N,N-trimethylmethanaminium
| Molecular Formula | C9H18NO2+ |
|---|---|
| Molecular Weight | 172.13376 g/mol |
| LogP | 0.2 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 172.13376 |
| Monoisotopic Mass | 172.13376 |
| Heavy Atoms | 12 |
| Complexity | 183.0 |
Chemical Identifiers
| CAS Number | 4780-69-2 |
|---|---|
| SMILES | C[C@H]1C(=O)C[C@H](O1)C[N+](C)(C)C |
| InChIKey | XKOQIVSZENKHPJ-YUMQZZPRSA-N |
Product Overview
trimethyl-[[(2S,5S)-5-methyl-4-oxooxolan-2-yl]methyl]azanium (CAS 4780-69-2), with molecular formula C9H18NO2+ and molecular weight 172.13376 g/mol. IUPAC: trimethyl-[[(2S,5S)-5-methyl-4-oxooxolan-2-yl]methyl]azanium.