ChemSpider 2D Image | 4-(Tri-1H-pyrazol-1-ylmethyl)aniline | C16H15N7

4-(Tri-1H-pyrazol-1-ylmethyl)aniline

  • Molecular FormulaC16H15N7
  • Average mass305.337 Da
  • Monoisotopic mass305.138885 Da
  • ChemSpider ID30658624

More details:

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

4-(Tri-1H-pyrazol-1-ylmethyl)anilin [German] [ACD/IUPAC Name]
4-(Tri-1H-pyrazol-1-ylmethyl)aniline [ACD/IUPAC Name]
4-(Tri-1H-pyrazol-1-ylméthyl)aniline [French] [ACD/IUPAC Name]
Benzenamine, 4-(tri-1H-pyrazol-1-ylmethyl)- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 584.9±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 87.4±3.0 kJ/mol
Flash Point: 307.6±30.1 °C
Index of Refraction: 1.728
Molar Refractivity: 89.6±0.5 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 1.97
ACD/LogD (pH 5.5): 1.80
ACD/BCF (pH 5.5): 13.73
ACD/KOC (pH 5.5): 226.99
ACD/LogD (pH 7.4): 1.80
ACD/BCF (pH 7.4): 13.74
ACD/KOC (pH 7.4): 227.07
Polar Surface Area: 79 Å2
Polarizability: 35.5±0.5 10-24cm3
Surface Tension: 64.3±7.0 dyne/cm
Molar Volume: 224.8±7.0 cm3

Click to predict properties on the Chemicalize site


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