ChemSpider 2D Image | 1-[1,3-Bis(2-methyl-2-propanyl)-1H-pyrazol-5-yl]-3-[3-(1H-imidazol-1-yl)propyl]urea | C18H30N6O

1-[1,3-Bis(2-methyl-2-propanyl)-1H-pyrazol-5-yl]-3-[3-(1H-imidazol-1-yl)propyl]urea

  • Molecular FormulaC18H30N6O
  • Average mass346.470 Da
  • Monoisotopic mass346.248108 Da
  • ChemSpider ID30332564

More details:

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

1-[1,3-Bis(2-methyl-2-propanyl)-1H-pyrazol-5-yl]-3-[3-(1H-imidazol-1-yl)propyl]harnstoff [German] [ACD/IUPAC Name]
1-[1,3-Bis(2-methyl-2-propanyl)-1H-pyrazol-5-yl]-3-[3-(1H-imidazol-1-yl)propyl]urea [ACD/IUPAC Name]
1-[1,3-Bis(2-méthyl-2-propanyl)-1H-pyrazol-5-yl]-3-[3-(1H-imidazol-1-yl)propyl]urée [French] [ACD/IUPAC Name]
Urea, N-[1,3-bis(1,1-dimethylethyl)-1H-pyrazol-5-yl]-N'-[3-(1H-imidazol-1-yl)propyl]- [ACD/Index 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: 510.9±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 78.2±3.0 kJ/mol
Flash Point: 262.8±30.1 °C
Index of Refraction: 1.571
Molar Refractivity: 101.3±0.5 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 2.75
ACD/LogD (pH 5.5): 1.43
ACD/BCF (pH 5.5): 3.15
ACD/KOC (pH 5.5): 29.88
ACD/LogD (pH 7.4): 2.77
ACD/BCF (pH 7.4): 68.68
ACD/KOC (pH 7.4): 651.65
Polar Surface Area: 77 Å2
Polarizability: 40.2±0.5 10-24cm3
Surface Tension: 40.3±7.0 dyne/cm
Molar Volume: 308.5±7.0 cm3

Click to predict properties on the Chemicalize site


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