Basic information
- CAS
63957-51-7- Standard SMILES
CCCC[N+](C)(C)CCOCC[N+](CC)(CC)CCCC.[Br-].[Br-]- InChIKey
IPIWKLKSFLQQEA-UHFFFAOYSA-L- Molecular formula
- C18H42Br2N2O
- Average molar mass
- 462.3 g/mol
- Monoisotopic mass
- 460.16639
Names & identifiers
- Preferred name
- Ammonium, N,N-diethyl-N',N'-dimethyl-N,N'-oxydiethylenebis(butyl-, dibromide
- IUPAC
- butyl-[2-[2-[butyl(diethyl)azaniumyl]ethoxy]ethyl]-dimethylazanium dibromide
Names & synonyms
AS-410163957-51-7AMMONIUM, N,N-DIETHYL-N',N'-DIMETHYL-N,N'-OXYDIETHYLENEBIS(BUTYL-, DIBROMIDERefChem:319408DTXSID00981365N-(2-{2-[Butyl(diethyl)azaniumyl]ethoxy}ethyl)-N,N-dimethylbutan-1-aminium dibromideN-(2-{2-[Butyldi(ethyl)azaniumyl]ethoxy}ethyl)-N,N-dimethylbutan-1-aminium dibromide
Database identifiers
- CAS
63957-51-7- PubChem CID
- 45733
- DTXSID
DTXSID00981365
Properties
Computed structural properties
- Topological polar surface area
- 9.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 14
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 237
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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