Basic information
- CAS
5423-65-4- Standard SMILES
CN(C)CCCCCCNCCC#N- InChIKey
CPLMVDBAKZDFOS-UHFFFAOYSA-N- Molecular formula
- C11H23N3
- Average molar mass
- 197.32 g/mol
- Monoisotopic mass
- 197.18919775
Names & identifiers
- Preferred name
- 3-[6-(Dimethylamino)hexylamino]propanenitrile
- IUPAC
- 3-[6-(dimethylamino)hexylamino]propanenitrile
Names & synonyms
5423-65-43-[6-(dimethylamino)hexylamino]propanenitrile3-{[6-(dimethylamino)hexyl]amino}propanenitrileNSC13223DTXSID00279572NSC 13223NSC-13223
Database identifiers
- CAS
5423-65-4- PubChem CID
- 224593
- DTXSID
DTXSID00279572
Properties
Computed structural properties
- XLogP
- 1
- Topological polar surface area
- 39.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 9
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 157
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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