N,N'-Bis(1,3-dimethylbutylidene)-4-methylcyclohexane-1,3-diamine
Basic information
- CAS
93859-07-5- Standard SMILES
CC(CC(C)C)=NC1CCC(C)C(N=C(C)CC(C)C)C1- InChIKey
XXHWBPRCTBQGPX-UHFFFAOYSA-N- Molecular formula
- C19H36N2
- Average molar mass
- 292.5 g/mol
- Monoisotopic mass
- 292.28784916
Names & identifiers
- Preferred name
- N,N'-Bis(1,3-dimethylbutylidene)-4-methylcyclohexane-1,3-diamine
- IUPAC
- 4-methyl-N-[4-methyl-3-(4-methylpentan-2-ylideneamino)cyclohexyl]pentan-2-imine
- English name
- N,N'-bis(1,3-dimethylbutylidene)-4-methylcyclohexane-1,3-diamine
- Molecular formula
- C19H36N2
- Molecular weight
- 292.5
Names & synonyms
EINECS 299-342-393859-07-5N,N'-Bis(1,3-dimethylbutylidene)-4-methylcyclohexane-1,3-diamineXXHWBPRCTBQGPX-UHFFFAOYSA-NDTXSID001168637NS00062902N,N'-(4-Methylcyclohexane-1,3-diyl)bis(4-methylpentan-2-imine)N1,N3-Bis(1,3-dimethylbutylidene)-4-methyl-1,3-cyclohexanediamineN,N'-Bis(1,3-dimethylbutylidene)-4-methyl-1,3-cyclohexanediamine
Database identifiers
- CAS
93859-07-5- PubChem CID
- 3022720
- DTXSID
DTXSID001168637- EC Number
- 299-342-3
- Nikkaji
- J317.750E
Properties
Computed structural properties
- XLogP
- 4.1
- Topological polar surface area
- 24.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 6
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 366
Physicochemical properties
- Boiling point
- 360.013 · 360.013±35.00 °C(Press: 760.00 Torr)(predicted)
- Density
- 0.934 · 0.934±0.14 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
- pka
- 7.689 · 7.689±0.60(predicted)
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Compound notes
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