ChemSpider 2D Image | N-[2-(4-Isopropyl-4H-1,2,4-triazol-3-yl)ethyl]-3-pentanamine | C12H24N4

N-[2-(4-Isopropyl-4H-1,2,4-triazol-3-yl)ethyl]-3-pentanamine

  • Molecular FormulaC12H24N4
  • Average mass224.346 Da
  • Monoisotopic mass224.200104 Da
  • ChemSpider ID29628284

More details:

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

4H-1,2,4-Triazole-3-ethanamine, N-(1-ethylpropyl)-4-(1-methylethyl)- [ACD/Index Name]
N-[2-(4-Isopropyl-4H-1,2,4-triazol-3-yl)ethyl]-3-pentanamin [German] [ACD/IUPAC Name]
N-[2-(4-Isopropyl-4H-1,2,4-triazol-3-yl)ethyl]-3-pentanamine [ACD/IUPAC Name]
N-[2-(4-Isopropyl-4H-1,2,4-triazol-3-yl)éthyl]-3-pentanamine [French] [ACD/IUPAC Name]
(1-ethylpropyl)[2-(4-isopropyl-4H-1,2,4-triazol-3-yl)ethyl]amine

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

Density: 1.0±0.1 g/cm3
Boiling Point: 352.6±44.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 59.7±3.0 kJ/mol
Flash Point: 167.0±28.4 °C
Index of Refraction: 1.531
Molar Refractivity: 67.7±0.5 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 1.87
ACD/LogD (pH 5.5): -1.14
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.35
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.38
Polar Surface Area: 43 Å2
Polarizability: 26.8±0.5 10-24cm3
Surface Tension: 33.5±7.0 dyne/cm
Molar Volume: 218.7±7.0 cm3

Click to predict properties on the Chemicalize site


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