ChemSpider 2D Image | 1-(3-Iodophenyl)-4,6-dimethyl-2(1H)-pyrimidinone | C12H11IN2O

1-(3-Iodophenyl)-4,6-dimethyl-2(1H)-pyrimidinone

  • Molecular FormulaC12H11IN2O
  • Average mass326.133 Da
  • Monoisotopic mass325.991608 Da
  • ChemSpider ID21142091

More details:

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

1-(3-Iodophenyl)-4,6-dimethyl-2(1H)-pyrimidinone [ACD/IUPAC Name]
1-(3-Iodophényl)-4,6-diméthyl-2(1H)-pyrimidinone [French] [ACD/IUPAC Name]
1-(3-Iodphenyl)-4,6-dimethyl-2(1H)-pyrimidinon [German] [ACD/IUPAC Name]
2(1H)-Pyrimidinone, 1-(3-iodophenyl)-4,6-dimethyl- [ACD/Index Name]

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

Density: 1.7±0.1 g/cm3
Boiling Point: 399.5±44.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 65.0±3.0 kJ/mol
Flash Point: 195.4±28.4 °C
Index of Refraction: 1.660
Molar Refractivity: 72.9±0.5 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 2.37
ACD/LogD (pH 5.5): 2.15
ACD/BCF (pH 5.5): 25.27
ACD/KOC (pH 5.5): 350.10
ACD/LogD (pH 7.4): 2.15
ACD/BCF (pH 7.4): 25.56
ACD/KOC (pH 7.4): 354.10
Polar Surface Area: 33 Å2
Polarizability: 28.9±0.5 10-24cm3
Surface Tension: 46.4±7.0 dyne/cm
Molar Volume: 197.4±7.0 cm3

Click to predict properties on the Chemicalize site


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