Basic information
- CAS
73067-73-9- Standard SMILES
CCCCCCCC(=O)NCCCCC(NC(=O)CCCCCCC)C(=O)NCCCN(C)C- InChIKey
QFTXUGHGFWWFJE-UHFFFAOYSA-N- Molecular formula
- C27H54N4O3
- Average molar mass
- 482.7 g/mol
- Monoisotopic mass
- 482.4195916
Names & identifiers
- Preferred name
- N,N'-(1-(((3-(Dimethylamino)propyl)amino)carbonyl)-1,5-pentanediyl)bisoctanamide
- IUPAC
- N-[6-[3-(dimethylamino)propylamino]-5-(octanoylamino)-6-oxohexyl]octanamide
- English name
- N,N'-[1-[[[3-(dimethylamino)propyl]amino]carbonyl]-1,5-pentanediyl]bisoctanamide
- Molecular formula
- C27H54N4O3
- Molecular weight
- 482.74
Names & synonyms
73067-73-9EINECS 277-264-0N,N'-[1-[[[3-(DIMETHYLAMINO)PROPYL]AMINO]CARBONYL]-1,5-PENTANEDIYL]BISOCTANAMIDEN,N'-(1-(((3-(Dimethylamino)propyl)amino)carbonyl)-1,5-pentanediyl)bisoctanamideDTXSID40993826QFTXUGHGFWWFJE-UHFFFAOYSA-NNS00058708N,N'-(6-{[3-(Dimethylamino)propyl]imino}-6-hydroxyhexane-1,5-diyl)dioctanimidic acidOctanamide, N,N'-[1-[[[3-(dimethylamino)propyl]amino]carbonyl]-1,5-pentanediyl]bis- (9CI)
Database identifiers
- CAS
73067-73-9- PubChem CID
- 44147397
- DTXSID
DTXSID40993826- EC Number
- 277-264-0
- Nikkaji
- J304.906J
Properties
Computed structural properties
- XLogP
- 5.7
- Topological polar surface area
- 90.5 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 23
- Heavy atoms
- 34
- Formal charge
- 0
- Complexity
- 526
Physicochemical properties
- Boiling point
- 712.3 · 712.3±60.0 °C(Predicted)
- Density
- 0.966 · 0.966±0.06 g/cm3(Predicted)
- pka
- 15 · 15.00±0.46(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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