ChemSpider 2D Image | 1,3,5-Triazinane-1,3,5-tricarbonitrile | C6H6N6

1,3,5-Triazinane-1,3,5-tricarbonitrile

  • Molecular FormulaC6H6N6
  • Average mass162.152 Da
  • Monoisotopic mass162.065399 Da
  • ChemSpider ID21112694

More details:

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

[1,3,5]-Triazinane-1,3,5-tricarbonitrile
1,3,5-Triazinan-1,3,5-tricarbonitril [German] [ACD/IUPAC Name]
1,3,5-Triazinane-1,3,5-tricarbonitrile [ACD/IUPAC Name]
1,3,5-Triazinane-1,3,5-tricarbonitrile [French] [ACD/IUPAC Name]
1,3,5-Triazine-1,3,5(2H,4H,6H)-tricarbonitrile [ACD/Index Name]
887582-46-9 [RN]
MFCD07367997 [MDL number]

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

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

Density: 1.5±0.1 g/cm3
Boiling Point: 629.4±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 93.1±3.0 kJ/mol
Flash Point: 321.0±19.4 °C
Index of Refraction: 1.626
Molar Refractivity: 39.3±0.4 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: -1.28
ACD/LogD (pH 5.5): -0.99
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 6.91
ACD/LogD (pH 7.4): -0.99
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 6.91
Polar Surface Area: 81 Å2
Polarizability: 15.6±0.5 10-24cm3
Surface Tension: 97.0±5.0 dyne/cm
Molar Volume: 110.8±5.0 cm3

Click to predict properties on the Chemicalize site


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