ChemSpider 2D Image | {3-Cyano-4-[(1E,3Z)-3-(1-decyl-4(1H)-quinolinylidene)-1-propen-1-yl]-5,5-dimethyl-2(5H)-furanylidene}malononitrile | C32H36N4O

{3-Cyano-4-[(1E,3Z)-3-(1-decyl-4(1H)-quinolinylidene)-1-propen-1-yl]-5,5-dimethyl-2(5H)-furanylidene}malononitrile

  • Molecular FormulaC32H36N4O
  • Average mass492.654 Da
  • Monoisotopic mass492.288910 Da
  • ChemSpider ID30654132

  • Double-bond stereo - Double-bond stereo

More details:

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

{3-Cyan-4-[(1E,3Z)-3-(1-decyl-4(1H)-chinolinyliden)-1-propen-1-yl]-5,5-dimethyl-2(5H)-furanyliden}malononitril [German] [ACD/IUPAC Name]
{3-Cyano-4-[(1E,3Z)-3-(1-décyl-4(1H)-quinoléinylidène)-1-propén-1-yl]-5,5-diméthyl-2(5H)-furanylidène}malononitrile [French] [ACD/IUPAC Name]
{3-Cyano-4-[(1E,3Z)-3-(1-decyl-4(1H)-quinolinylidene)-1-propen-1-yl]-5,5-dimethyl-2(5H)-furanylidene}malononitrile [ACD/IUPAC Name]
Propanedinitrile, 2-[3-cyano-4-[(1E,3Z)-3-(1-decyl-4(1H)-quinolinylidene)-1-propen-1-yl]-5,5-dimethyl-2(5H)-furanylidene]- [ACD/Index Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 586.6±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 87.6±3.0 kJ/mol
Flash Point: 308.5±30.1 °C
Index of Refraction: 1.591
Molar Refractivity: 146.9±0.4 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 14
#Rule of 5 Violations: 1
ACD/LogP: 7.66
ACD/LogD (pH 5.5): 8.56
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 1079581.88
ACD/LogD (pH 7.4): 8.56
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 1079712.25
Polar Surface Area: 84 Å2
Polarizability: 58.2±0.5 10-24cm3
Surface Tension: 53.5±5.0 dyne/cm
Molar Volume: 434.5±5.0 cm3

Click to predict properties on the Chemicalize site


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