Nobutan
3-[4-(9,9-dimethyl-3-aza-9-azoniabicyclo[3.3.1]nonan-3-yl)butyl]-9,9-dimethyl-3-aza-9-azoniabicyclo[3.3.1]nonane diiodide
| Molecular Formula | C22H44I2N4 |
|---|---|
| Molecular Weight | 618.4 g/mol |
| Topological Polar Surface Area | 6.5 A2 |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 618.1655 |
| Heavy Atoms | 28 |
| Complexity | 413.0 |
Chemical Identifiers
| CAS Number | 3406-44-8 |
|---|---|
| SMILES | C[N+]1(C2CCCC1CN(C2)CCCCN3CC4CCCC(C3)[N+]4(C)C)C.[I-].[I-] |
| InChIKey | QVNVGTVAPQGSOF-UHFFFAOYSA-L |
📖 Product Overview
Nobutan (CAS: 3406-44-8) is a chemical compound with molecular formula C22H44I2N4 and molecular weight 618.4 g/mol. Its IUPAC systematic name is 3-[4-(9,9-dimethyl-3-aza-9-azoniabicyclo[3.3.1]nonan-3-yl)butyl]-9,9-dimethyl-3-aza-9-azoniabicyclo[3.3.1]nonane diiodide.
QVNVGTVAPQGSOF-UHFFFAOYSA-L.
SMILES: C[N+]1(C2CCCC1CN(C2)CCCCN3CC4CCCC(C3)[N+]4(C)C)C.[I-].[I-].
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