ChemSpider 2D Image | N,N-Dibutyl-N'-[3-(dimethylamino)propyl]-2-[4-(2-methyl-2-propanyl)phenyl]-N'-propyl-4,6-pyrimidinediamine | C30H51N5

N,N-Dibutyl-N'-[3-(dimethylamino)propyl]-2-[4-(2-methyl-2-propanyl)phenyl]-N'-propyl-4,6-pyrimidinediamine

  • Molecular FormulaC30H51N5
  • Average mass481.759 Da
  • Monoisotopic mass481.414459 Da
  • ChemSpider ID122005059

More details:

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

4,6-Pyrimidinediamine, N4,N4-dibutyl-N6-[3-(dimethylamino)propyl]-2-[4-(1,1-dimethylethyl)phenyl]-N6-propyl- [ACD/Index Name]
N,N-Dibutyl-N'-[3-(dimethylamino)propyl]-2-[4-(2-methyl-2-propanyl)phenyl]-N'-propyl-4,6-pyrimidindiamin [German] [ACD/IUPAC Name]
N,N-Dibutyl-N'-[3-(dimethylamino)propyl]-2-[4-(2-methyl-2-propanyl)phenyl]-N'-propyl-4,6-pyrimidinediamine [ACD/IUPAC Name]
N,N-Dibutyl-N'-[3-(diméthylamino)propyl]-2-[4-(2-méthyl-2-propanyl)phényl]-N'-propyl-4,6-pyrimidinediamine [French] [ACD/IUPAC Name]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 544.8±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 82.3±3.0 kJ/mol
Flash Point: 283.3±30.1 °C
Index of Refraction: 1.539
Molar Refractivity: 153.4±0.3 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 16
#Rule of 5 Violations: 1
ACD/LogP: 8.75
ACD/LogD (pH 5.5): 4.17
ACD/BCF (pH 5.5): 138.74
ACD/KOC (pH 5.5): 136.08
ACD/LogD (pH 7.4): 5.38
ACD/BCF (pH 7.4): 2264.89
ACD/KOC (pH 7.4): 2221.48
Polar Surface Area: 36 Å2
Polarizability: 60.8±0.5 10-24cm3
Surface Tension: 39.2±3.0 dyne/cm
Molar Volume: 489.2±3.0 cm3

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