ChemSpider 2D Image | 1-(4-Amino-6-methyl-1,3,5-triazin-2-yl)-N-(1H-pyrazol-3-yl)-1H-benzimidazol-2-amine | C14H13N9

1-(4-Amino-6-methyl-1,3,5-triazin-2-yl)-N-(1H-pyrazol-3-yl)-1H-benzimidazol-2-amine

  • Molecular FormulaC14H13N9
  • Average mass307.313 Da
  • Monoisotopic mass307.129395 Da
  • ChemSpider ID26328719

More details:






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

1-(4-Amino-6-methyl-1,3,5-triazin-2-yl)-N-(1H-pyrazol-3-yl)-1H-benzimidazol-2-amin [German] [ACD/IUPAC Name]
1-(4-Amino-6-methyl-1,3,5-triazin-2-yl)-N-(1H-pyrazol-3-yl)-1H-benzimidazol-2-amine [ACD/IUPAC Name]
1-(4-Amino-6-méthyl-1,3,5-triazin-2-yl)-N-(1H-pyrazol-3-yl)-1H-benzimidazol-2-amine [French] [ACD/IUPAC Name]
1H-Benzimidazol-2-amine, 1-(4-amino-6-methyl-1,3,5-triazin-2-yl)-N-1H-pyrazol-3-yl- [ACD/Index Name]
1239978-70-1 [RN]
QAR

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.7±0.1 g/cm3
Boiling Point: 725.3±52.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 105.9±3.0 kJ/mol
Flash Point: 392.4±30.7 °C
Index of Refraction: 1.878
Molar Refractivity: 83.9±0.5 cm3
#H bond acceptors: 9
#H bond donors: 4
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 1.10
ACD/LogD (pH 5.5): 1.27
ACD/BCF (pH 5.5): 5.41
ACD/KOC (pH 5.5): 114.96
ACD/LogD (pH 7.4): 1.29
ACD/BCF (pH 7.4): 5.66
ACD/KOC (pH 7.4): 120.21
Polar Surface Area: 123 Å2
Polarizability: 33.3±0.5 10-24cm3
Surface Tension: 79.2±7.0 dyne/cm
Molar Volume: 183.6±7.0 cm3

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