ChemSpider 2D Image | 2-Cyano-3-(4-iodo-phenyl)-succinonitrile | C11H6IN3

2-Cyano-3-(4-iodo-phenyl)-succinonitrile

  • Molecular FormulaC11H6IN3
  • Average mass307.090 Da
  • Monoisotopic mass306.960632 Da
  • ChemSpider ID20057518

More details:

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

1,1,2-Ethanetricarbonitrile, 2-(4-iodophenyl)- [ACD/Index Name]
2-(4-Iodophenyl)-1,1,2-ethanetricarbonitrile [ACD/IUPAC Name]
2-(4-Iodophényl)-1,1,2-éthanetricarbonitrile [French] [ACD/IUPAC Name]
2-(4-Iodophenyl)ethane-1,1,2-tricarbonitrile
2-(4-Iodphenyl)-1,1,2-ethantricarbonitril [German] [ACD/IUPAC Name]
2-Cyano-3-(4-iodo-phenyl)-succinonitrile

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

Density: 1.8±0.1 g/cm3
Boiling Point: 480.1±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 74.4±3.0 kJ/mol
Flash Point: 244.1±28.7 °C
Index of Refraction: 1.630
Molar Refractivity: 62.3±0.3 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 2.66
ACD/LogD (pH 5.5): 2.61
ACD/BCF (pH 5.5): 56.68
ACD/KOC (pH 5.5): 626.19
ACD/LogD (pH 7.4): 2.61
ACD/BCF (pH 7.4): 56.68
ACD/KOC (pH 7.4): 626.19
Polar Surface Area: 71 Å2
Polarizability: 24.7±0.5 10-24cm3
Surface Tension: 66.3±3.0 dyne/cm
Molar Volume: 175.1±3.0 cm3

Click to predict properties on the Chemicalize site


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