ChemSpider 2D Image | (1R,5R)-9-Benzyl-2,4-dioxo-3,9-diazaspiro[5.5]undecane-1,5-dicarbonitrile | C18H18N4O2

(1R,5R)-9-Benzyl-2,4-dioxo-3,9-diazaspiro[5.5]undecane-1,5-dicarbonitrile

  • Molecular FormulaC18H18N4O2
  • Average mass322.361 Da
  • Monoisotopic mass322.142975 Da
  • ChemSpider ID32809756

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(1R,5R)-9-Benzyl-2,4-dioxo-3,9-diazaspiro[5.5]undecan-1,5-dicarbonitril [German] [ACD/IUPAC Name]
(1R,5R)-9-Benzyl-2,4-dioxo-3,9-diazaspiro[5.5]undecane-1,5-dicarbonitrile [ACD/IUPAC Name]
(1R,5R)-9-Benzyl-2,4-dioxo-3,9-diazaspiro[5.5]undécane-1,5-dicarbonitrile [French] [ACD/IUPAC Name]
3,9-Diazaspiro[5.5]undecane-1,5-dicarbonitrile, 2,4-dioxo-9-(phenylmethyl)-, (1R,5R)- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 613.4±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 91.0±3.0 kJ/mol
Flash Point: 324.7±31.5 °C
Index of Refraction: 1.615
Molar Refractivity: 85.9±0.4 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 1.47
ACD/LogD (pH 5.5):
ACD/BCF (pH 5.5):
ACD/KOC (pH 5.5):
ACD/LogD (pH 7.4):
ACD/BCF (pH 7.4):
ACD/KOC (pH 7.4):
Polar Surface Area: 97 Å2
Polarizability: 34.0±0.5 10-24cm3
Surface Tension: 66.0±5.0 dyne/cm
Molar Volume: 246.1±5.0 cm3

Click to predict properties on the Chemicalize site


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