Basic information
- CAS
101122-64-9- Standard SMILES
CC[N+](CC)(CC)CCCCCCCCCCCC[N+](CC)(CC)CC.[Br-].[Br-]- InChIKey
ZPGQJMZSOYWJQD-UHFFFAOYSA-L- Molecular formula
- C24H54Br2N2
- Average molar mass
- 530.5 g/mol
- Monoisotopic mass
- 528.26537
Names & identifiers
- Preferred name
- 1,12-Dodecanediaminium, N,N,N,N',N',N'-hexaethyl-, dibromide
- IUPAC
- triethyl-[12-(triethylazaniumyl)dodecyl]azanium dibromide
Names & synonyms
101122-64-9N1,N1,N1,N12,N12,N12-Hexaethyldodecane-1,12-diaminium bromideCHEMBL1465071,12-Dodecanediaminium, N,N,N,N',N',N'-hexaethyl-, dibromideDTXSID00443610SY493630triethyl-[12-(triethylazaniumyl)dodecyl]azanium;dibromideN~1~,N~1~,N~1~,N~12~,N~12~,N~12~-Hexaethyldodecane-1,12-bis(aminium) dibromide
Database identifiers
- CAS
101122-64-9- PubChem CID
- 10697513
- DTXSID
DTXSID00443610- ChEMBL
CHEMBL146507
Properties
Computed structural properties
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 19
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 246
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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