ChemSpider 2D Image | trans-N-(2-Aminoethyl)-N-cyclopropyl-N',N'-dimethyl-1,4-cyclohexanediamine | C13H27N3

trans-N-(2-Aminoethyl)-N-cyclopropyl-N',N'-dimethyl-1,4-cyclohexanediamine

  • Molecular FormulaC13H27N3
  • Average mass225.374 Da
  • Monoisotopic mass225.220505 Da
  • ChemSpider ID28298840

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

1,4-Cyclohexanediamine, N1-(2-aminoethyl)-N1-cyclopropyl-N4,N4-dimethyl-, trans- [ACD/Index Name]
trans-N-(2-Aminoethyl)-N-cyclopropyl-N',N'-dimethyl-1,4-cyclohexandiamin [German] [ACD/IUPAC Name]
trans-N-(2-Aminoethyl)-N-cyclopropyl-N',N'-dimethyl-1,4-cyclohexanediamine [ACD/IUPAC Name]
trans-N-(2-Aminoéthyl)-N-cyclopropyl-N',N'-diméthyl-1,4-cyclohexanediamine [French] [ACD/IUPAC Name]
(1R,4R)-N-(2-aminoethyl)-N-cyclopropyl-N',N'-dimethylcyclohexane-1,4-diamine
(1R,4R)-N-(2-aminoethyl)-N-cyclopropyl-N',N'-dimethyl-cyclohexane-1,4-diamine
(1R,4R)-N-(2-Amino-ethyl)-N-cyclopropyl-N',N'-dimethyl-cyclohexane-1,4-diamine
MFCD21094230

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.0±0.1 g/cm3
Boiling Point: 318.2±10.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 56.0±3.0 kJ/mol
Flash Point: 144.3±13.8 °C
Index of Refraction: 1.531
Molar Refractivity: 69.5±0.4 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 0.65
ACD/LogD (pH 5.5): -3.36
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.19
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 33 Å2
Polarizability: 27.5±0.5 10-24cm3
Surface Tension: 41.1±5.0 dyne/cm
Molar Volume: 224.4±5.0 cm3

Click to predict properties on the Chemicalize site


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