Basic information
- CAS
73680-60-1- Standard SMILES
CCCC[N+](CC)(CC)CCCNC1=CC(=O)C(NCCC[N+](CC)(CC)CCCC)=CC1=O.[Br-].[Br-]- InChIKey
BBUPIQNENPAKLY-UHFFFAOYSA-N- Molecular formula
- C28H54Br2N4O2
- Average molar mass
- 638.6 g/mol
- Monoisotopic mass
- 636.26135
Names & identifiers
- Preferred name
- Ammonium, (p-benzoquinon-2,5-ylenebis(iminotrimethylene))bis(butyldiethyl-, dibromide
- IUPAC
- butyl-[3-[[4-[3-[butyl(diethyl)azaniumyl]propylamino]-3,6-dioxocyclohexa-1,4-dien-1-yl]amino]propyl]-diethylazanium dibromide
Names & synonyms
Ammonium, (p-benzoquinon-2,5-ylenebis(iminotrimethylene))bis(butyldiethyl-, dibromide73680-60-1RefChem:1076817NSC 231593Benzoquinone, 2,5-bis(3-diethylaminopropylamino), bis-butobromideDTXSID2013845741-Butanaminium, N,N'-((3,6-dioxo-1,4-cyclohexadiene-1,4-diyl)bis(imino-3,1-propanediyl))bis(N,N-diethyl-, dibromide
Database identifiers
- CAS
73680-60-1- PubChem CID
- 52116
- DTXSID
DTXSID201384574
Properties
Computed structural properties
- Topological polar surface area
- 58.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 20
- Heavy atoms
- 36
- Formal charge
- 0
- Complexity
- 618
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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