ChemSpider 2D Image | 1-(2-{[2-Hydroxy-3-(4-nitro-1H-pyrazol-1-yl)propyl]amino}ethyl)urea | C9H16N6O4

1-(2-{[2-Hydroxy-3-(4-nitro-1H-pyrazol-1-yl)propyl]amino}ethyl)urea

  • Molecular FormulaC9H16N6O4
  • Average mass272.261 Da
  • Monoisotopic mass272.123291 Da
  • ChemSpider ID46048894

More details:

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

1-(2-{[2-Hydroxy-3-(4-nitro-1H-pyrazol-1-yl)propyl]amino}ethyl)harnstoff [German] [ACD/IUPAC Name]
1-(2-{[2-Hydroxy-3-(4-nitro-1H-pyrazol-1-yl)propyl]amino}ethyl)urea [ACD/IUPAC Name]
1-(2-{[2-Hydroxy-3-(4-nitro-1H-pyrazol-1-yl)propyl]amino}éthyl)urée [French] [ACD/IUPAC Name]
Urea, N-[2-[[2-hydroxy-3-(4-nitro-1H-pyrazol-1-yl)propyl]amino]ethyl]- [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: 537.4±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 85.7±3.0 kJ/mol
Flash Point: 278.8±30.1 °C
Index of Refraction: 1.671
Molar Refractivity: 63.9±0.5 cm3
#H bond acceptors: 10
#H bond donors: 5
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 2
ACD/LogP: -1.22
ACD/LogD (pH 5.5): -3.46
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.76
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.22
Polar Surface Area: 151 Å2
Polarizability: 25.3±0.5 10-24cm3
Surface Tension: 76.2±7.0 dyne/cm
Molar Volume: 170.7±7.0 cm3

Click to predict properties on the Chemicalize site


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