ChemSpider 2D Image | 6-[(1-Acetyl-4-piperidinyl)oxy]nicotinonitrile | C13H15N3O2

6-[(1-Acetyl-4-piperidinyl)oxy]nicotinonitrile

  • Molecular FormulaC13H15N3O2
  • Average mass245.277 Da
  • Monoisotopic mass245.116425 Da
  • ChemSpider ID30752211

More details:

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

3-Pyridinecarbonitrile, 6-[(1-acetyl-4-piperidinyl)oxy]- [ACD/Index Name]
6-[(1-Acetyl-4-piperidinyl)oxy]nicotinonitril [German] [ACD/IUPAC Name]
6-[(1-Acetyl-4-piperidinyl)oxy]nicotinonitrile [ACD/IUPAC Name]
6-[(1-Acétyl-4-pipéridinyl)oxy]nicotinonitrile [French] [ACD/IUPAC Name]
1421496-73-2 [RN]
6-((1-acetylpiperidin-4-yl)oxy)nicotinonitrile
6-[(1-ACETYLPIPERIDIN-4-YL)OXY]PYRIDINE-3-CARBONITRILE

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

Density: 1.2±0.1 g/cm3
Boiling Point: 450.4±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 70.9±3.0 kJ/mol
Flash Point: 226.2±28.7 °C
Index of Refraction: 1.568
Molar Refractivity: 65.2±0.4 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 1.18
ACD/LogD (pH 5.5): 1.05
ACD/BCF (pH 5.5): 3.68
ACD/KOC (pH 5.5): 88.51
ACD/LogD (pH 7.4): 1.05
ACD/BCF (pH 7.4): 3.68
ACD/KOC (pH 7.4): 88.51
Polar Surface Area: 66 Å2
Polarizability: 25.8±0.5 10-24cm3
Surface Tension: 57.0±5.0 dyne/cm
Molar Volume: 199.3±5.0 cm3

Click to predict properties on the Chemicalize site


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