ChemSpider 2D Image | N~1~-[2-(4-Chlorophenyl)-6-(2-methyl-2-propanyl)-4-pyrimidinyl]-N~4~,N~4~-diethyl-2-methyl-1,4-benzenediamine | C25H31ClN4

N1-[2-(4-Chlorophenyl)-6-(2-methyl-2-propanyl)-4-pyrimidinyl]-N4,N4-diethyl-2-methyl-1,4-benzenediamine

  • Molecular FormulaC25H31ClN4
  • Average mass422.993 Da
  • Monoisotopic mass422.223724 Da
  • ChemSpider ID67262256

More details:

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

1,4-Benzenediamine, N1-[2-(4-chlorophenyl)-6-(1,1-dimethylethyl)-4-pyrimidinyl]-N4,N4-diethyl-2-methyl- [ACD/Index Name]
N1-[2-(4-Chlorophenyl)-6-(2-methyl-2-propanyl)-4-pyrimidinyl]-N4,N4-diethyl-2-methyl-1,4-benzenediamine [ACD/IUPAC Name]
N1-[2-(4-Chlorophényl)-6-(2-méthyl-2-propanyl)-4-pyrimidinyl]-N4,N4-diéthyl-2-méthyl-1,4-benzènediamine [French] [ACD/IUPAC Name]
N1-[2-(4-Chlorphenyl)-6-(2-methyl-2-propanyl)-4-pyrimidinyl]-N4,N4-diethyl-2-methyl-1,4-benzoldiamin [German] [ACD/IUPAC Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 496.7±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 76.4±3.0 kJ/mol
Flash Point: 254.2±28.7 °C
Index of Refraction: 1.603
Molar Refractivity: 128.1±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 7.18
ACD/LogD (pH 5.5): 5.55
ACD/BCF (pH 5.5): 4901.70
ACD/KOC (pH 5.5): 6701.54
ACD/LogD (pH 7.4): 6.74
ACD/BCF (pH 7.4): 75458.55
ACD/KOC (pH 7.4): 103165.97
Polar Surface Area: 41 Å2
Polarizability: 50.8±0.5 10-24cm3
Surface Tension: 44.8±3.0 dyne/cm
Molar Volume: 373.1±3.0 cm3

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