Basic information
- CAS
25151-31-9- Standard SMILES
CCCCCCCCCCCCCCCCCCNC(=O)CCCCC(=O)NCCCCCCCCCCCCCCCCCC- InChIKey
QIJSQGXDFAYEAF-UHFFFAOYSA-N- Molecular formula
- C42H84N2O2
- Average molar mass
- 649.1 g/mol
- Monoisotopic mass
- 648.65327993
Overview
See also: Hexanediamide, N,N'-dioctadecyl- (annotation moved to).
Names & identifiers
- Preferred name
- N,N'-Dioctadecyladipamide
- IUPAC
- N,N'-dioctadecylhexanediamide
- English name
- N,N'-dioctadecyladipamide
- Molecular formula
- C42H84N2O2
- Molecular weight
- 649.13
Names & synonyms
N,N'-Dioctadecyladipamide25151-31-9EINECS 246-663-1Slipacks ZSAn,n'-distearyladipamideTT4V7VCJ9RSCHEMBL226108N1,N6-DioctadecylhexanediamideDTXSID80179829QIJSQGXDFAYEAF-UHFFFAOYSA-NHexanediamide, N1,N6-dioctadecyl-N,N'-Bis(stearyl)adipic acid amide
Show more names
N,N'-Dioctadecylhexanediamide
N~1~,N~6~-DioctadecylhexanediamideN,N'-DIOCTADECYL ADIPIC AMIDENS00027819Q63398950
Database identifiers
- CAS
25151-31-9- PubChem CID
- 91304
- DTXSID
DTXSID80179829- UNII
- TT4V7VCJ9R
- EC Number
- 246-663-1
- Nikkaji
- J236.067E
Properties
Computed structural properties
- XLogP
- 17.1
- Topological polar surface area
- 58.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 39
- Heavy atoms
- 46
- Formal charge
- 0
- Complexity
- 556
Physicochemical properties
- Melting point
- 145 · 145-146 °C
- Boiling point
- 757.4 · 757.4±43.0 °C(Predicted)
- Density
- 0.884 · 0.884±0.06 g/cm3(Predicted)
- pka
- 16.05 · 16.05±0.46(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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