Dodecyl-[6-[dodecyl(dimethyl)azaniumyl]hexyl]-dimethylazanium
Basic information
- CAS
18464-57-8- Standard SMILES
CCCCCCCCCCCC[N+](C)(C)CCCCCC[N+](C)(C)CCCCCCCCCCCC- InChIKey
RWRBPONYOROPPI-UHFFFAOYSA-N- Molecular formula
- C34H74N2+2
- Average molar mass
- 511 g/mol
- Monoisotopic mass
- 510.58520037
Names & identifiers
- Preferred name
- Dodecyl-[6-[dodecyl(dimethyl)azaniumyl]hexyl]-dimethylazanium
- IUPAC
- dodecyl-[6-[dodecyl(dimethyl)azaniumyl]hexyl]-dimethylazanium
Names & synonyms
18464-57-8CHEMBL1180890SCHEMBL25212141DTXSID80274747N,N'-Didodecyl-N,N,N',N'-tetramethyl-1,6-hexanediaminiumN~1~,N~6~-Didodecyl-N~1~,N~1~,N~6~,N~6~-tetramethylhexane-1,6-bis(aminium)
Database identifiers
- CAS
18464-57-8- PubChem CID
- 23615
- DTXSID
DTXSID80274747- ChEMBL
CHEMBL1180890- Nikkaji
- J641.145B
Properties
Computed structural properties
- XLogP
- 12.9
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 29
- Heavy atoms
- 36
- Formal charge
- 2
- Complexity
- 389
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Related reactions
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Compound notes
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