Basic information
- CAS
111588-20-6- Standard SMILES
C[N+]1(CCOCCOCC[N+]2(C)CCCCC2)CCCCC1.[I-].[I-]- InChIKey
VTOYPPBWXHVFGZ-UHFFFAOYSA-L- Molecular formula
- C18H38I2N2O2
- Average molar mass
- 568.3 g/mol
- Monoisotopic mass
- 568.10227
Names & identifiers
- Preferred name
- Piperidinium, 1,1'-(ethylenebis(oxyethylene))bis(1-methyl-, diiodide
- IUPAC
- 1-methyl-1-[2-[2-[2-(1-methylpiperidin-1-ium-1-yl)ethoxy]ethoxy]ethyl]piperidin-1-ium diiodide
Names & synonyms
504 HC111588-20-61,1'-(Ethylenebis(oxyethylene))bis(1-methylpiperidinium iodide)Piperidinium, 1,1'-(ethylenebis(oxyethylene))bis(1-methyl-, diiodideDiiodomethylate de N,N'bis(piperidylethoxy)ethylene [French]Diiodomethylate de N,N'bis(piperidylethoxy)ethyleneRefChem:373357SCHEMBL29788813DTXSID209122321,1'-[Ethane-1,2-diylbis(oxyethane-2,1-diyl)]bis(1-methylpiperidin-1-ium) diiodide
Database identifiers
- CAS
111588-20-6- PubChem CID
- 3047762
- DTXSID
DTXSID20912232
Properties
Computed structural properties
- Topological polar surface area
- 18.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 9
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 267
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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