ChemSpider 2D Image | 6-(1H-Pyrrolo[2,3-b]pyridin-4-yl)[1,2,4]triazolo[4,3-a]pyrimidine | C12H8N6

6-(1H-Pyrrolo[2,3-b]pyridin-4-yl)[1,2,4]triazolo[4,3-a]pyrimidine

  • Molecular FormulaC12H8N6
  • Average mass236.232 Da
  • Monoisotopic mass236.081039 Da
  • ChemSpider ID57626813

More details:

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

1,2,4-Triazolo[4,3-a]pyrimidine, 6-(1H-pyrrolo[2,3-b]pyridin-4-yl)- [ACD/Index Name]
6-(1H-Pyrrolo[2,3-b]pyridin-4-yl)[1,2,4]triazolo[4,3-a]pyrimidin [German] [ACD/IUPAC Name]
6-(1H-Pyrrolo[2,3-b]pyridin-4-yl)[1,2,4]triazolo[4,3-a]pyrimidine [ACD/IUPAC Name]
6-(1H-Pyrrolo[2,3-b]pyridin-4-yl)[1,2,4]triazolo[4,3-a]pyrimidine [French] [ACD/IUPAC Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.879
Molar Refractivity: 66.9±0.5 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 0.67
ACD/LogD (pH 5.5): 0.86
ACD/BCF (pH 5.5): 2.67
ACD/KOC (pH 5.5): 70.32
ACD/LogD (pH 7.4): 0.86
ACD/BCF (pH 7.4): 2.67
ACD/KOC (pH 7.4): 70.32
Polar Surface Area: 72 Å2
Polarizability: 26.5±0.5 10-24cm3
Surface Tension: 76.0±7.0 dyne/cm
Molar Volume: 146.1±7.0 cm3

Click to predict properties on the Chemicalize site


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