2-Pipecolinium, (4,4'-biphenylylenebis(2-oxoethylene))bis(1-methyl-, diiodide
Basic information
- CAS
23617-24-5- Standard SMILES
CC1CC=CC[N+]1(C)OCCc1ccc(-c2ccc(CCO[N+]3(C)CC=CCC3C)cc2)cc1.[I-].[I-]- InChIKey
OBPSPSGWVRIREE-UHFFFAOYSA-L- Molecular formula
- C30H42I2N2O2
- Average molar mass
- 716.5 g/mol
- Monoisotopic mass
- 716.13357
Names & identifiers
- Preferred name
- 2-Pipecolinium, (4,4'-biphenylylenebis(2-oxoethylene))bis(1-methyl-, diiodide
- IUPAC
- 1-[2-[4-[4-[2-[(1,2-dimethyl-3,6-dihydro-2H-pyridin-1-ium-1-yl)oxy]ethyl]phenyl]phenyl]ethoxy]-1,2-dimethyl-3,6-dihydro-2H-pyridin-1-ium diiodide
Names & synonyms
23617-24-52-Pipecolinium, (4,4'-biphenylylenebis(2-oxoethylene))bis(1-methyl-, diiodidePiperidinium, (4,4'-biphenylylenebis(2-oxoethylene))bis(1,2-dimethyl-, diiodideRefChem:265432DTXSID609464351,1'-[[1,1'-Biphenyl]-4,4'-diylbis(ethane-2,1-diyloxy)]bis(1,2-dimethyl-1,2,3,6-tetrahydropyridin-1-ium) diiodide1,1'-{[1,1'-Biphenyl]-4,4'-diylbis[(ethane-2,1-diyl)oxy]}bis(1,2-dimethyl-1,2,3,6-tetrahydropyridin-1-ium) diiodide
Database identifiers
- CAS
23617-24-5- PubChem CID
- 90214
- DTXSID
DTXSID60946435
Properties
Computed structural properties
- Topological polar surface area
- 18.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 9
- Heavy atoms
- 36
- Formal charge
- 0
- Complexity
- 619
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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