Basic information
- CAS
70055-52-6- Standard SMILES
CCCCCCCCCCCCCCCCCC(=O)NCCN(CCC#N)CCNC(=O)CCCCCCCCCCCCCCCCC- InChIKey
FKQHSBAADFHUQW-UHFFFAOYSA-N- Molecular formula
- C43H84N4O2
- Average molar mass
- 689.2 g/mol
- Monoisotopic mass
- 688.65942793
Names & identifiers
- Preferred name
- Octadecanamide, N,N'-(((2-cyanoethyl)imino)di-2,1-ethanediyl)bis-
- IUPAC
- N-[2-[2-cyanoethyl-[2-(octadecanoylamino)ethyl]amino]ethyl]octadecanamide
- English name
- N,N'-[[(2-cyanoethyl)imino]diethane-1,2-diyl]distearamide
- Molecular formula
- C43H84N4O2
- Molecular weight
- 689.15266
Names & synonyms
EINECS 274-292-5Octadecanamide, N,N'-[[(2-cyanoethyl)imino]di-2,1-ethanediyl]bis-DTXSID9072026N,N'-Distearoyl-N''-cyanoethyldiethylenetriamineOctadecanamide, N,N'-(((2-cyanoethyl)imino)di-2,1-ethanediyl)bis-RefChem:855469DTXCID804661870055-52-6N,N'-(((2-cyanoethyl)azanediyl)bis(ethane-2,1-diyl))distearamideVYP9KN3AFQFKQHSBAADFHUQW-UHFFFAOYSA-NNS00036997
Show more names
N,N'-[[(2-cyanoethyl)imino]diethane-1,2-diyl]distearamide
N,N'-(((2-Cyanoethyl)imino)diethane-1,2-diyl)distearamideN,N'-[[(2-Cyanoethyl)imino]di-2,1-ethanediyl]bis[octadecanamide]N,N'-{[(2-Cyanoethyl)azanediyl]di(ethane-2,1-diyl)}dioctadecanamide
Database identifiers
- CAS
70055-52-6- PubChem CID
- 112359
- DTXSID
DTXSID9072026- UNII
Properties
Computed structural properties
- XLogP
- 15.4
- Topological polar surface area
- 85.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 40
- Heavy atoms
- 49
- Formal charge
- 0
- Complexity
- 697
Physicochemical properties
- EPA Substance Registry System
- 2 · Octadecanamide, N,N'-[[(2-cyanoethyl)imino]di-2,1-ethanediyl]bis- (70055-52-6)
- TSCA
- TSCA listed
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationOctadecanamide, N,N'-[[(2-cyanoethyl)imino]di-2,1-ethanediyl]bis-: ACTIVE
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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