ChemSpider 2D Image | 3-(4-Pyridinyl)-1,5,6,7-tetrahydro[1,2,4]triazolo[4,3-a]pyrimidine | C10H11N5

3-(4-Pyridinyl)-1,5,6,7-tetrahydro[1,2,4]triazolo[4,3-a]pyrimidine

  • Molecular FormulaC10H11N5
  • Average mass201.228 Da
  • Monoisotopic mass201.101440 Da
  • ChemSpider ID23369927

More details:






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

1,2,4-Triazolo[4,3-a]pyrimidine, 5,6,7,8-tetrahydro-3-(4-pyridinyl)- [ACD/Index Name]
3-(4-Pyridinyl)-1,5,6,7-tetrahydro[1,2,4]triazolo[4,3-a]pyrimidin [German] [ACD/IUPAC Name]
3-(4-Pyridinyl)-1,5,6,7-tetrahydro[1,2,4]triazolo[4,3-a]pyrimidine [ACD/IUPAC Name]
3-(4-Pyridinyl)-1,5,6,7-tétrahydro[1,2,4]triazolo[4,3-a]pyrimidine [French] [ACD/IUPAC Name]
3-(Pyridin-4-yl)-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrimidine
157871-55-1 [RN]
3-(4-pyridinyl)-5,6,7,8-tetrahydro-1,2,4-triazolo[4,3-a]pyrimidine
3-(Pyridin-4-yl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyrimidine
3-pyridin-4-yl-1,5,6,7-tetrahydro-[1,2,4]triazolo[4,3-a]pyrimidine
4-{5H,6H,7H,8H-[1,2,4]Triazolo[4,3-a]pyrimidin-3-yl}pyridine
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.5±0.1 g/cm3
Boiling Point: 446.5±47.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 70.5±3.0 kJ/mol
Flash Point: 223.9±29.3 °C
Index of Refraction: 1.769
Molar Refractivity: 57.2±0.5 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 0.53
ACD/LogD (pH 5.5): 0.93
ACD/BCF (pH 5.5): 2.97
ACD/KOC (pH 5.5): 75.81
ACD/LogD (pH 7.4): 0.93
ACD/BCF (pH 7.4): 2.99
ACD/KOC (pH 7.4): 76.24
Polar Surface Area: 56 Å2
Polarizability: 22.7±0.5 10-24cm3
Surface Tension: 63.9±7.0 dyne/cm
Molar Volume: 137.7±7.0 cm3

Click to predict properties on the Chemicalize site






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