ChemSpider 2D Image | 1-{1-[4-(2-Hydroxybutyl)-1-piperazinyl]-1-oxo-2-propanyl}urea | C12H24N4O3

1-{1-[4-(2-Hydroxybutyl)-1-piperazinyl]-1-oxo-2-propanyl}urea

  • Molecular FormulaC12H24N4O3
  • Average mass272.344 Da
  • Monoisotopic mass272.184845 Da
  • ChemSpider ID30175434

More details:

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

1-{1-[4-(2-Hydroxybutyl)-1-piperazinyl]-1-oxo-2-propanyl}harnstoff [German] [ACD/IUPAC Name]
1-{1-[4-(2-Hydroxybutyl)-1-piperazinyl]-1-oxo-2-propanyl}urea [ACD/IUPAC Name]
1-{1-[4-(2-Hydroxybutyl)-1-pipérazinyl]-1-oxo-2-propanyl}urée [French] [ACD/IUPAC Name]
Urea, N-[2-[4-(2-hydroxybutyl)-1-piperazinyl]-1-methyl-2-oxoethyl]- [ACD/Index Name]
{1-[4-(2-HYDROXYBUTYL)PIPERAZIN-1-YL]-1-OXOPROPAN-2-YL}UREA

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

Density: 1.2±0.1 g/cm3
Boiling Point: 471.1±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.7 mmHg at 25°C
Enthalpy of Vaporization: 84.6±6.0 kJ/mol
Flash Point: 238.7±28.7 °C
Index of Refraction: 1.528
Molar Refractivity: 71.3±0.3 cm3
#H bond acceptors: 7
#H bond donors: 4
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: -0.73
ACD/LogD (pH 5.5): -1.33
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 2.87
ACD/LogD (pH 7.4): -0.90
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 7.64
Polar Surface Area: 99 Å2
Polarizability: 28.2±0.5 10-24cm3
Surface Tension: 50.0±3.0 dyne/cm
Molar Volume: 231.3±3.0 cm3

Click to predict properties on the Chemicalize site


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