ChemSpider 2D Image | N-Isobutyl-2,2-dimethyl-N-[2-(1H-1,2,4-triazol-1-yl)ethyl]-1-propanamine | C13H26N4

N-Isobutyl-2,2-dimethyl-N-[2-(1H-1,2,4-triazol-1-yl)ethyl]-1-propanamine

  • Molecular FormulaC13H26N4
  • Average mass238.372 Da
  • Monoisotopic mass238.215744 Da
  • ChemSpider ID30124172

More details:

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

1H-1,2,4-Triazole-1-ethanamine, N-(2,2-dimethylpropyl)-N-(2-methylpropyl)- [ACD/Index Name]
N-Isobutyl-2,2-dimethyl-N-[2-(1H-1,2,4-triazol-1-yl)ethyl]-1-propanamin [German] [ACD/IUPAC Name]
N-Isobutyl-2,2-dimethyl-N-[2-(1H-1,2,4-triazol-1-yl)ethyl]-1-propanamine [ACD/IUPAC Name]
N-Isobutyl-2,2-diméthyl-N-[2-(1H-1,2,4-triazol-1-yl)éthyl]-1-propanamine [French] [ACD/IUPAC Name]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 335.2±44.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 57.8±3.0 kJ/mol
Flash Point: 156.5±28.4 °C
Index of Refraction: 1.511
Molar Refractivity: 73.5±0.5 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 2.46
ACD/LogD (pH 5.5): -0.19
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.13
ACD/LogD (pH 7.4): 1.47
ACD/BCF (pH 7.4): 4.36
ACD/KOC (pH 7.4): 51.10
Polar Surface Area: 34 Å2
Polarizability: 29.2±0.5 10-24cm3
Surface Tension: 32.6±7.0 dyne/cm
Molar Volume: 245.4±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement