Basic information
- CAS
36888-36-5- Standard SMILES
CCC(C)=NCCCCCCN=C(C)CC- InChIKey
COEITCNWTMGMTR-UHFFFAOYSA-N- Molecular formula
- C14H28N2
- Average molar mass
- 224.39 g/mol
- Monoisotopic mass
- 224.2252489
Names & identifiers
- Preferred name
- N1,N6-Bis(1-methylpropylidene)-1,6-hexanediamine
- IUPAC
- N-[6-(butan-2-ylideneamino)hexyl]butan-2-imine
- English name
- N,N'-Bis(1-methylpropylidene)-1,6-hexanediamine
- Molecular formula
- C14H28N2
- Molecular weight
- 224.39
Names & synonyms
36888-36-5RefChem:365069N1,N6-Bis(1-methylpropylidene)-1,6-hexanediamineN,N'-Bis(1-methylpropylidene)-1,6-hexanediamine1,6-HEXANEDIAMINE, N,N'-BIS(1-METHYLPROPYLIDENE)-SCHEMBL1932614SCHEMBL11892003DTXSID401031981
Database identifiers
- CAS
36888-36-5- PubChem CID
- 37568
- DTXSID
DTXSID401031981- Nikkaji
- J36.962D
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 24.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 9
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 193
Physicochemical properties
- Boiling point
- 320.641 · 320.641±25.00 °C(Press: 760.00 Torr)(predicted)
- Density
- 0.85 · 0.850±0.14 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
- pka
- 8.416 · 8.416±0.50(predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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