Basic information
- CAS
35096-61-8- Standard SMILES
C[N+]1(CC2COC(CCCCCCCCC3OCC(C[N+]4(C)CCCC4)O3)O2)CCCC1.[I-].[I-]- InChIKey
SYMKFCVLLMWNCA-UHFFFAOYSA-L- Molecular formula
- C26H50I2N2O4
- Average molar mass
- 708.5 g/mol
- Monoisotopic mass
- 708.186
Names & identifiers
- Preferred name
- Pyrrolidinium, 1,1'-(1,8-octanediylbis(1,3-dioxolane-2,4-diylmethylene))bis(1-methyl-, diiodide
- IUPAC
- 1-methyl-1-[[2-[8-[4-[(1-methylpyrrolidin-1-ium-1-yl)methyl]-1,3-dioxolan-2-yl]octyl]-1,3-dioxolan-4-yl]methyl]pyrrolidin-1-ium diiodide
Names & synonyms
35096-61-81,1'-(1,8-Octanediylbis(1,3-dioxolane-2,4-diylmethylene))bis(1-methylpyrrolidinium) diiodide1,8-Bis-(4'-pyrrolidinomethyl-1',3'-dioxolanyl-2')-octane dimethyl iodidePyrrolidinium, 1,1'-(1,8-octanediylbis(1,3-dioxolane-2,4-diylmethylene))bis(1-methyl-, diiodideRefChem:378109DTXSID209565301,1'-[Octane-1,8-diylbis(1,3-dioxolane-2,4-diylmethylene)]bis(1-methylpyrrolidin-1-ium) diiodide1,1'-{Octane-1,8-diylbis[(1,3-dioxolane-2,4-diyl)methylene]}bis(1-methylpyrrolidin-1-ium) diiodide
Database identifiers
- CAS
35096-61-8- PubChem CID
- 215151
- DTXSID
DTXSID20956530
Properties
Computed structural properties
- Topological polar surface area
- 36.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 13
- Heavy atoms
- 34
- Formal charge
- 0
- Complexity
- 500
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…