ChemSpider 2D Image | (2-Iodophenyl)[4-(6-methyl-4-pyrimidinyl)-1-piperazinyl]methanone | C16H17IN4O

(2-Iodophenyl)[4-(6-methyl-4-pyrimidinyl)-1-piperazinyl]methanone

  • Molecular FormulaC16H17IN4O
  • Average mass408.237 Da
  • Monoisotopic mass408.044708 Da
  • ChemSpider ID34709670

More details:

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

(2-Iodophenyl)[4-(6-methyl-4-pyrimidinyl)-1-piperazinyl]methanone [ACD/IUPAC Name]
(2-Iodophényl)[4-(6-méthyl-4-pyrimidinyl)-1-pipérazinyl]méthanone [French] [ACD/IUPAC Name]
(2-Iodphenyl)[4-(6-methyl-4-pyrimidinyl)-1-piperazinyl]methanon [German] [ACD/IUPAC Name]
Methanone, (2-iodophenyl)[4-(6-methyl-4-pyrimidinyl)-1-piperazinyl]- [ACD/Index Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 564.4±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 84.8±3.0 kJ/mol
Flash Point: 295.1±30.1 °C
Index of Refraction: 1.656
Molar Refractivity: 93.6±0.3 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 1.43
ACD/LogD (pH 5.5): 0.08
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 2.52
ACD/LogD (pH 7.4): 1.57
ACD/BCF (pH 7.4): 6.03
ACD/KOC (pH 7.4): 77.24
Polar Surface Area: 49 Å2
Polarizability: 37.1±0.5 10-24cm3
Surface Tension: 60.3±3.0 dyne/cm
Molar Volume: 254.6±3.0 cm3

Click to predict properties on the Chemicalize site


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