ChemSpider 2D Image | 5-{[4-(4-Cyclohexyl-1H-1,2,3-triazol-1-yl)-1-piperidinyl]methyl}-2-methylpyrimidine | C19H28N6

5-{[4-(4-Cyclohexyl-1H-1,2,3-triazol-1-yl)-1-piperidinyl]methyl}-2-methylpyrimidine

  • Molecular FormulaC19H28N6
  • Average mass340.466 Da
  • Monoisotopic mass340.237549 Da
  • ChemSpider ID22379041

More details:

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

5-{[4-(4-Cyclohexyl-1H-1,2,3-triazol-1-yl)-1-piperidinyl]methyl}-2-methylpyrimidin [German] [ACD/IUPAC Name]
5-{[4-(4-Cyclohexyl-1H-1,2,3-triazol-1-yl)-1-piperidinyl]methyl}-2-methylpyrimidine [ACD/IUPAC Name]
5-{[4-(4-Cyclohexyl-1H-1,2,3-triazol-1-yl)-1-pipéridinyl]méthyl}-2-méthylpyrimidine [French] [ACD/IUPAC Name]
Pyrimidine, 5-[[4-(4-cyclohexyl-1H-1,2,3-triazol-1-yl)-1-piperidinyl]methyl]-2-methyl- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 505.1±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 77.5±3.0 kJ/mol
Flash Point: 259.3±32.9 °C
Index of Refraction: 1.681
Molar Refractivity: 99.9±0.5 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 1.89
ACD/LogD (pH 5.5): 1.53
ACD/BCF (pH 5.5): 5.67
ACD/KOC (pH 5.5): 73.86
ACD/LogD (pH 7.4): 2.25
ACD/BCF (pH 7.4): 30.00
ACD/KOC (pH 7.4): 390.85
Polar Surface Area: 60 Å2
Polarizability: 39.6±0.5 10-24cm3
Surface Tension: 52.0±7.0 dyne/cm
Molar Volume: 263.9±7.0 cm3

Click to predict properties on the Chemicalize site


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