ChemSpider 2D Image | 4-Amino-4-cyclohexene-1,1,3,3,5-pentacarbonitrile | C11H6N6

4-Amino-4-cyclohexene-1,1,3,3,5-pentacarbonitrile

  • Molecular FormulaC11H6N6
  • Average mass222.206 Da
  • Monoisotopic mass222.065399 Da
  • ChemSpider ID28708583

More details:

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

4-Amino-4-cyclohexen-1,1,3,3,5-pentacarbonitril [German] [ACD/IUPAC Name]
4-Amino-4-cyclohexene-1,1,3,3,5-pentacarbonitrile [ACD/IUPAC Name]
4-Amino-4-cyclohexène-1,1,3,3,5-pentacarbonitrile [French] [ACD/IUPAC Name]
4-Cyclohexene-1,1,3,3,5-pentacarbonitrile, 4-amino- [ACD/Index Name]
4-Aminocyclohex-4-ene-1,1,3,3,5-pentacarbonitrile
91634-99-0 [RN]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 756.6±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.5 mmHg at 25°C
Enthalpy of Vaporization: 110.2±3.0 kJ/mol
Flash Point: 411.4±32.9 °C
Index of Refraction: 1.595
Molar Refractivity: 53.7±0.4 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 0.27
ACD/LogD (pH 5.5): 0.68
ACD/BCF (pH 5.5): 1.94
ACD/KOC (pH 5.5): 55.94
ACD/LogD (pH 7.4): 0.68
ACD/BCF (pH 7.4): 1.95
ACD/KOC (pH 7.4): 56.06
Polar Surface Area: 145 Å2
Polarizability: 21.3±0.5 10-24cm3
Surface Tension: 92.2±5.0 dyne/cm
Molar Volume: 158.3±5.0 cm3

Click to predict properties on the Chemicalize site


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