ChemSpider 2D Image | N-[2-(1H-Pyrazol-1-yl)benzyl]-3H-purin-6-amine | C15H13N7

N-[2-(1H-Pyrazol-1-yl)benzyl]-3H-purin-6-amine

  • Molecular FormulaC15H13N7
  • Average mass291.311 Da
  • Monoisotopic mass291.123230 Da
  • ChemSpider ID22756231

More details:

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

9H-Purin-6-amine, N-[[2-(1H-pyrazol-1-yl)phenyl]methyl]- [ACD/Index Name]
N-[2-(1H-Pyrazol-1-yl)benzyl]-3H-purin-6-amin [German] [ACD/IUPAC Name]
N-[2-(1H-Pyrazol-1-yl)benzyl]-3H-purin-6-amine [ACD/IUPAC Name]
N-[2-(1H-Pyrazol-1-yl)benzyl]-3H-purin-6-amine [French] [ACD/IUPAC Name]
N-[2-(1H-pyrazol-1-yl)benzyl]-9H-purin-6-amine

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

Density: 1.5±0.1 g/cm3
Boiling Point: 624.5±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 92.5±3.0 kJ/mol
Flash Point: 331.5±30.1 °C
Index of Refraction: 1.783
Molar Refractivity: 83.8±0.5 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 1.94
ACD/LogD (pH 5.5): 2.15
ACD/BCF (pH 5.5): 25.19
ACD/KOC (pH 5.5): 349.40
ACD/LogD (pH 7.4): 2.15
ACD/BCF (pH 7.4): 25.37
ACD/KOC (pH 7.4): 351.85
Polar Surface Area: 84 Å2
Polarizability: 33.2±0.5 10-24cm3
Surface Tension: 65.8±7.0 dyne/cm
Molar Volume: 199.1±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement