ChemSpider 2D Image | 3-{[4-(2-Pyrimidinyl)-1-piperazinyl]methyl}-1,4,5,6-tetrahydrocyclopenta[c]pyrazole | C15H20N6

3-{[4-(2-Pyrimidinyl)-1-piperazinyl]methyl}-1,4,5,6-tetrahydrocyclopenta[c]pyrazole

  • Molecular FormulaC15H20N6
  • Average mass284.359 Da
  • Monoisotopic mass284.174957 Da
  • ChemSpider ID22351335

More details:

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

3-{[4-(2-Pyrimidinyl)-1-piperazinyl]methyl}-1,4,5,6-tetrahydrocyclopenta[c]pyrazol [German] [ACD/IUPAC Name]
3-{[4-(2-Pyrimidinyl)-1-piperazinyl]methyl}-1,4,5,6-tetrahydrocyclopenta[c]pyrazole [ACD/IUPAC Name]
3-{[4-(2-Pyrimidinyl)-1-pipérazinyl]méthyl}-1,4,5,6-tétrahydrocyclopenta[c]pyrazole [French] [ACD/IUPAC Name]
Cyclopenta[c]pyrazole, 1,4,5,6-tetrahydro-3-[[4-(2-pyrimidinyl)-1-piperazinyl]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: 517.6±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 79.0±3.0 kJ/mol
Flash Point: 266.8±32.9 °C
Index of Refraction: 1.655
Molar Refractivity: 80.1±0.3 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 1.72
ACD/LogD (pH 5.5): 1.65
ACD/BCF (pH 5.5): 9.10
ACD/KOC (pH 5.5): 140.26
ACD/LogD (pH 7.4): 1.94
ACD/BCF (pH 7.4): 17.37
ACD/KOC (pH 7.4): 267.74
Polar Surface Area: 61 Å2
Polarizability: 31.7±0.5 10-24cm3
Surface Tension: 72.3±3.0 dyne/cm
Molar Volume: 218.1±3.0 cm3

Click to predict properties on the Chemicalize site


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