ChemSpider 2D Image | 4-(4-Methyl-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)benzonitrile | C16H10N2O2

4-(4-Methyl-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)benzonitrile

  • Molecular FormulaC16H10N2O2
  • Average mass262.263 Da
  • Monoisotopic mass262.074219 Da
  • ChemSpider ID25056677

More details:






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

4-(4-Methyl-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)benzonitril [German] [ACD/IUPAC Name]
4-(4-Methyl-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)benzonitrile [ACD/IUPAC Name]
4-(4-Méthyl-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)benzonitrile [French] [ACD/IUPAC Name]
Benzonitrile, 4-(1,3-dihydro-4-methyl-1,3-dioxo-2H-isoindol-2-yl)- [ACD/Index Name]
4-(4-methyl-1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl)benzonitrile
4-(4-methyl-1,3-dioxoisoindol-2-yl)benzonitrile
C16

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.4±0.1 g/cm3
Boiling Point: 499.5±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 76.8±3.0 kJ/mol
Flash Point: 255.9±31.5 °C
Index of Refraction: 1.682
Molar Refractivity: 72.0±0.4 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 2.30
ACD/LogD (pH 5.5): 1.86
ACD/BCF (pH 5.5): 15.25
ACD/KOC (pH 5.5): 244.71
ACD/LogD (pH 7.4): 1.86
ACD/BCF (pH 7.4): 15.25
ACD/KOC (pH 7.4): 244.71
Polar Surface Area: 61 Å2
Polarizability: 28.5±0.5 10-24cm3
Surface Tension: 69.6±5.0 dyne/cm
Molar Volume: 190.1±5.0 cm3

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