ChemSpider 2D Image | 6-[4-(5-Fluoro-2-pyrimidinyl)-1-piperazinyl]nicotinonitrile | C14H13FN6

6-[4-(5-Fluoro-2-pyrimidinyl)-1-piperazinyl]nicotinonitrile

  • Molecular FormulaC14H13FN6
  • Average mass284.292 Da
  • Monoisotopic mass284.118561 Da
  • ChemSpider ID81408344

More details:

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

3-Pyridinecarbonitrile, 6-[4-(5-fluoro-2-pyrimidinyl)-1-piperazinyl]- [ACD/Index Name]
6-[4-(5-Fluor-2-pyrimidinyl)-1-piperazinyl]nicotinonitril [German] [ACD/IUPAC Name]
6-[4-(5-Fluoro-2-pyrimidinyl)-1-piperazinyl]nicotinonitrile [ACD/IUPAC Name]
6-[4-(5-Fluoro-2-pyrimidinyl)-1-pipérazinyl]nicotinonitrile [French] [ACD/IUPAC Name]
2415532-37-3 [RN]
6-[4-(5-fluoropyrimidin-2-yl)piperazin-1-yl]pyridine-3-carbonitrile

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

Density: 1.4±0.1 g/cm3
Boiling Point: 536.1±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 81.3±3.0 kJ/mol
Flash Point: 278.0±32.9 °C
Index of Refraction: 1.647
Molar Refractivity: 73.8±0.4 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.05
ACD/LogD (pH 5.5): 1.74
ACD/BCF (pH 5.5): 11.45
ACD/KOC (pH 5.5): 183.52
ACD/LogD (pH 7.4): 1.86
ACD/BCF (pH 7.4): 15.23
ACD/KOC (pH 7.4): 244.15
Polar Surface Area: 69 Å2
Polarizability: 29.2±0.5 10-24cm3
Surface Tension: 77.7±5.0 dyne/cm
Molar Volume: 203.0±5.0 cm3

Click to predict properties on the Chemicalize site


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