ChemSpider 2D Image | 5-[(6-Methyl-2-pyridinyl)ethynyl]nicotinonitrile | C14H9N3

5-[(6-Methyl-2-pyridinyl)ethynyl]nicotinonitrile

  • Molecular FormulaC14H9N3
  • Average mass219.241 Da
  • Monoisotopic mass219.079651 Da
  • ChemSpider ID24672135

More details:

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

3-Pyridinecarbonitrile, 5-[2-(6-methyl-2-pyridinyl)ethynyl]- [ACD/Index Name]
5-[(6-Methyl-2-pyridinyl)ethinyl]nicotinonitril [German] [ACD/IUPAC Name]
5-[(6-Methyl-2-pyridinyl)ethynyl]nicotinonitrile [ACD/IUPAC Name]
5-[(6-Méthyl-2-pyridinyl)éthynyl]nicotinonitrile [French] [ACD/IUPAC Name]
5-((6-Methylpyridin-2-yl)ethynyl)nicotinonitrile

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

Density: 1.2±0.1 g/cm3
Boiling Point: 413.9±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 66.7±3.0 kJ/mol
Flash Point: 136.7±13.9 °C
Index of Refraction: 1.633
Molar Refractivity: 63.5±0.4 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.03
ACD/LogD (pH 5.5): 2.14
ACD/BCF (pH 5.5): 25.10
ACD/KOC (pH 5.5): 349.44
ACD/LogD (pH 7.4): 2.14
ACD/BCF (pH 7.4): 25.12
ACD/KOC (pH 7.4): 349.73
Polar Surface Area: 50 Å2
Polarizability: 25.2±0.5 10-24cm3
Surface Tension: 68.4±5.0 dyne/cm
Molar Volume: 178.0±5.0 cm3

Click to predict properties on the Chemicalize site


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