ChemSpider 2D Image | 2-(4-Iodophenyl)-5-pyrimidinecarbonitrile | C11H6IN3

2-(4-Iodophenyl)-5-pyrimidinecarbonitrile

  • Molecular FormulaC11H6IN3
  • Average mass307.090 Da
  • Monoisotopic mass306.960632 Da
  • ChemSpider ID29362810

More details:

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

1447606-05-4 [RN]
2-(4-Iodophenyl)-5-pyrimidinecarbonitrile [ACD/IUPAC Name]
2-(4-Iodophényl)-5-pyrimidinecarbonitrile [French] [ACD/IUPAC Name]
2-(4-IODOPHENYL)PYRIMIDINE-5-CARBONITRILE
2-(4-Iodphenyl)-5-pyrimidincarbonitril [German] [ACD/IUPAC Name]
5-Pyrimidinecarbonitrile, 2-(4-iodophenyl)- [ACD/Index Name]
MFCD23140494

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

Density: 1.9±0.1 g/cm3
Boiling Point: 314.2±34.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 55.5±3.0 kJ/mol
Flash Point: 143.8±25.7 °C
Index of Refraction: 1.708
Molar Refractivity: 64.5±0.4 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 2.95
ACD/LogD (pH 5.5): 2.55
ACD/BCF (pH 5.5): 51.28
ACD/KOC (pH 5.5): 582.86
ACD/LogD (pH 7.4): 2.55
ACD/BCF (pH 7.4): 51.28
ACD/KOC (pH 7.4): 582.86
Polar Surface Area: 50 Å2
Polarizability: 25.6±0.5 10-24cm3
Surface Tension: 76.7±5.0 dyne/cm
Molar Volume: 165.6±5.0 cm3

Click to predict properties on the Chemicalize site


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