Basic information
- CAS
69696-98-6- Standard SMILES
CCCC[N+](CCCC)(CCCC)CCCCCC[N+](CCCC)(CCCC)CCCC.[Br-].[Br-]- InChIKey
AJKVEYVXGDNCQX-UHFFFAOYSA-L- Molecular formula
- C30H66Br2N2
- Average molar mass
- 614.7 g/mol
- Monoisotopic mass
- 612.35928
Names & identifiers
- Preferred name
- 1,6-Hexanediaminium, N1,N1,N1,N6,N6,N6-hexabutyl-, bromide (1:2)
- IUPAC
- tributyl-[6-(tributylazaniumyl)hexyl]azanium dibromide
Names & synonyms
69696-98-61,6-Hexanediaminium, N,N,N,N',N',N'-hexabutyl-, dibromideDTXSID508900341,6-Hexanediaminium, N1,N1,N1,N6,N6,N6-hexabutyl-, bromide (1:2)RefChem:73625DTXCID301029286SCHEMBL8586767AJKVEYVXGDNCQX-UHFFFAOYSA-Ltributyl-[6-(tributylazaniumyl)hexyl]azanium;dibromideN~1~,N~1~,N~1~,N~6~,N~6~,N~6~-Hexabutylhexane-1,6-bis(aminium) dibromide
Database identifiers
- CAS
69696-98-6- PubChem CID
- 112293
- DTXSID
DTXSID50890034
Properties
Computed structural properties
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 25
- Heavy atoms
- 34
- Formal charge
- 0
- Complexity
- 299
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Hazard information
Regulatory InformationPMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.
Chemistry & industry
Uses & manufacturing
General Manufacturing Information1,6-Hexanediaminium, N1,N1,N1,N6,N6,N6-hexabutyl-, bromide (1:2): INACTIVE
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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