ChemSpider 2D Image | N-Ethyl-N-(2-{4-[(isobutylamino)methyl]-1H-1,2,3-triazol-1-yl}ethyl)-2-methyl-1-butanamine | C16H33N5

N-Ethyl-N-(2-{4-[(isobutylamino)methyl]-1H-1,2,3-triazol-1-yl}ethyl)-2-methyl-1-butanamine

  • Molecular FormulaC16H33N5
  • Average mass295.467 Da
  • Monoisotopic mass295.273590 Da
  • ChemSpider ID52143852

More details:

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

1H-1,2,3-Triazole-1-ethanamine, N-ethyl-N-(2-methylbutyl)-4-[[(2-methylpropyl)amino]methyl]- [ACD/Index Name]
N-Ethyl-N-(2-{4-[(isobutylamino)methyl]-1H-1,2,3-triazol-1-yl}ethyl)-2-methyl-1-butanamin [German] [ACD/IUPAC Name]
N-Ethyl-N-(2-{4-[(isobutylamino)methyl]-1H-1,2,3-triazol-1-yl}ethyl)-2-methyl-1-butanamine [ACD/IUPAC Name]
N-Éthyl-N-(2-{4-[(isobutylamino)méthyl]-1H-1,2,3-triazol-1-yl}éthyl)-2-méthyl-1-butanamine [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: 399.0±52.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 65.0±3.0 kJ/mol
Flash Point: 195.1±30.7 °C
Index of Refraction: 1.525
Molar Refractivity: 89.9±0.5 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 0
ACD/LogP: 2.95
ACD/LogD (pH 5.5): -1.31
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.98
ACD/BCF (pH 7.4): 1.24
ACD/KOC (pH 7.4): 12.98
Polar Surface Area: 46 Å2
Polarizability: 35.6±0.5 10-24cm3
Surface Tension: 33.9±7.0 dyne/cm
Molar Volume: 293.1±7.0 cm3

Click to predict properties on the Chemicalize site


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