3,3'-Oxybis(N,N-diethyl-N-methylpropan-1-aminium) diiodide
Basic information
- CAS
64049-60-1- Standard SMILES
CC[N+](C)(CC)CCCOCCC[N+](C)(CC)CC.[I-].[I-]- InChIKey
HAHHOMVBRQUNQK-UHFFFAOYSA-L- Molecular formula
- C16H38I2N2O
- Average molar mass
- 528.29 g/mol
- Monoisotopic mass
- 528.10736
Names & identifiers
- Preferred name
- 3,3'-Oxybis(N,N-diethyl-N-methylpropan-1-aminium) diiodide
- IUPAC
- 3-[3-[diethyl(methyl)azaniumyl]propoxy]propyl-diethyl-methylazanium diiodide
Names & synonyms
64049-60-1DTXSID009823373,3'-Oxybis(N,N-diethyl-N-methylpropan-1-aminium) diiodideRefChem:1065556DTXCID501409600AMMONIUM, OXYBIS(TRIMETHYLENE)BIS(DIETHYLMETHYL-, DIIODIDEAKOS024360558ST50990489{3-[3-(diethylmethylamino)propoxy]propyl}diethylmethylamine, iodide, iodide
Database identifiers
- CAS
64049-60-1- PubChem CID
- 46893
- DTXSID
DTXSID00982337
Properties
Computed structural properties
- Topological polar surface area
- 9.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 12
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 189
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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