4,7,10,13,16-Pentaazanonadecanedinitrile
Basic information
- CAS
3216-98-6- Standard SMILES
N#CCCNCCNCCNCCNCCNCCC#N- InChIKey
QYNDCVPRVZOXJJ-UHFFFAOYSA-N- Molecular formula
- C14H29N7
- Average molar mass
- 295.43 g/mol
- Monoisotopic mass
- 295.24844395
Names & identifiers
- Preferred name
- 4,7,10,13,16-Pentaazanonadecanedinitrile
- IUPAC
- 3-[2-[2-[2-[2-(2-cyanoethylamino)ethylamino]ethylamino]ethylamino]ethylamino]propanenitrile
- English name
- 4,7,10,13,16-pentaazanonadecanedinitrile
- Molecular formula
- C14H29N7
- Molecular weight
- 295.43
Names & synonyms
4,7,10,13,16-Pentaazanonadecanedinitrile3216-98-6EINECS 221-736-0DTXSID7062908RefChem:96698DTXCID6038459221-736-04,7,10,13,16-pentaazanonadecane-1,19-dinitrileQYNDCVPRVZOXJJ-UHFFFAOYSA-NNS00029224
Database identifiers
- CAS
3216-98-6- PubChem CID
- 76683
- DTXSID
DTXSID7062908- EC Number
- 221-736-0
- Nikkaji
- J262.322F
Properties
Computed structural properties
- XLogP
- -2.5
- Topological polar surface area
- 108 Ų
- Hydrogen bond donors
- 5
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 16
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 271
Physicochemical properties
- EPA Substance Registry System
- 4 · 4,7,10,13,16-Pentaazanonadecanedinitrile (3216-98-6)
- 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 Information4,7,10,13,16-Pentaazanonadecanedinitrile: INACTIVE
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Related reactions
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Compound notes
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