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Search term: TXYIYGOHWGLULK (Found by InChIKey (skeleton match))
ChemSpider 2D Image | 2-(1H-Pyrazol-1-yl)nicotinonitrile | C9H6N4

2-(1H-Pyrazol-1-yl)nicotinonitrile

  • Molecular FormulaC9H6N4
  • Average mass170.171 Da
  • Monoisotopic mass170.059250 Da
  • ChemSpider ID21763803

More details:

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

1152822-31-5 [RN]
2-(1H-Pyrazol-1-yl)nicotinonitril [German] [ACD/IUPAC Name]
2-(1H-Pyrazol-1-yl)nicotinonitrile [ACD/IUPAC Name]
2-(1H-Pyrazol-1-yl)nicotinonitrile [French] [ACD/IUPAC Name]
3-Pyridinecarbonitrile, 2-(1H-pyrazol-1-yl)- [ACD/Index Name]
[1152822-31-5] [RN]
2-(1H-Pyrazol-1-yl)pyridine-3-carbonitrile
2-(pyrazol-1-yl)-3-cyanopyridine
2-(PYRAZOL-1-YL)PYRIDINE-3-CARBONITRILE
2-pyrazol-1-ylpyridine-3-carbonitrile
More...

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

CCRIS 4693 [DBID]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 353.8±27.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 59.9±3.0 kJ/mol
Flash Point: 167.8±23.7 °C
Index of Refraction: 1.663
Molar Refractivity: 50.9±0.5 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 1.89
ACD/LogD (pH 5.5): 1.04
ACD/BCF (pH 5.5): 3.65
ACD/KOC (pH 5.5): 87.89
ACD/LogD (pH 7.4): 1.04
ACD/BCF (pH 7.4): 3.65
ACD/KOC (pH 7.4): 87.89
Polar Surface Area: 55 Å2
Polarizability: 20.2±0.5 10-24cm3
Surface Tension: 54.4±7.0 dyne/cm
Molar Volume: 137.4±7.0 cm3

Click to predict properties on the Chemicalize site


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