ChemSpider 2D Image | N-[2,4-Dimethyl-5-(1H-1,2,4-triazol-1-ylmethyl)benzyl]-N-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]ethanamine | C22H32N6

N-[2,4-Dimethyl-5-(1H-1,2,4-triazol-1-ylmethyl)benzyl]-N-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]ethanamine

  • Molecular FormulaC22H32N6
  • Average mass380.530 Da
  • Monoisotopic mass380.268860 Da
  • ChemSpider ID29628031

More details:

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

1H-Pyrazole-4-methanamine, N-[[2,4-dimethyl-5-(1H-1,2,4-triazol-1-ylmethyl)phenyl]methyl]-N,1-diethyl-3,5-dimethyl- [ACD/Index Name]
N-[2,4-Dimethyl-5-(1H-1,2,4-triazol-1-ylmethyl)benzyl]-N-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]ethanamin [German] [ACD/IUPAC Name]
N-[2,4-Dimethyl-5-(1H-1,2,4-triazol-1-ylmethyl)benzyl]-N-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]ethanamine [ACD/IUPAC Name]
N-[2,4-Diméthyl-5-(1H-1,2,4-triazol-1-ylméthyl)benzyl]-N-[(1-éthyl-3,5-diméthyl-1H-pyrazol-4-yl)méthyl]éthanamine [French] [ACD/IUPAC Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 537.3±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 81.4±3.0 kJ/mol
Flash Point: 278.8±32.9 °C
Index of Refraction: 1.594
Molar Refractivity: 116.2±0.5 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 3.60
ACD/LogD (pH 5.5): 1.83
ACD/BCF (pH 5.5): 3.95
ACD/KOC (pH 5.5): 19.89
ACD/LogD (pH 7.4): 3.54
ACD/BCF (pH 7.4): 201.46
ACD/KOC (pH 7.4): 1015.59
Polar Surface Area: 52 Å2
Polarizability: 46.1±0.5 10-24cm3
Surface Tension: 39.1±7.0 dyne/cm
Molar Volume: 342.3±7.0 cm3

Click to predict properties on the Chemicalize site


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