ChemSpider 2D Image | 4-{(Z)-[(5Z)-5-Benzylidene-3,6-dioxo-2-piperazinylidene]methyl}-5-(2-methyl-2-propanyl)-1H-imidazol-3-ium | C19H21N4O2

4-{(Z)-[(5Z)-5-Benzylidene-3,6-dioxo-2-piperazinylidene]methyl}-5-(2-methyl-2-propanyl)-1H-imidazol-3-ium

  • Molecular FormulaC19H21N4O2
  • Average mass337.395 Da
  • Monoisotopic mass337.165894 Da
  • ChemSpider ID21204746

  • Charge - Charge

    Double-bond stereo - Double-bond stereo

More details:

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

1H-Imidazolium, 5-(1,1-dimethylethyl)-4-[(Z)-[(5Z)-3,6-dioxo-5-(phenylmethylene)-2-piperazinylidene]methyl]- [ACD/Index Name]
4-{(Z)-[(5Z)-5-Benzyliden-3,6-dioxo-2-piperazinyliden]methyl}-5-(2-methyl-2-propanyl)-1H-imidazol-3-ium [German] [ACD/IUPAC Name]
4-{(Z)-[(5Z)-5-Benzylidene-3,6-dioxo-2-piperazinylidene]methyl}-5-(2-methyl-2-propanyl)-1H-imidazol-3-ium [ACD/IUPAC Name]
4-{(Z)-[(5Z)-5-Benzylidène-3,6-dioxo-2-pipérazinylidène]méthyl}-5-(2-méthyl-2-propanyl)-1H-imidazol-3-ium [French] [ACD/IUPAC Name]

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

Density:
Boiling Point: 730.3±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 106.6±3.0 kJ/mol
Flash Point: 395.5±32.9 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 6
#H bond donors: 3
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.66
ACD/LogD (pH 5.5): 1.64
ACD/BCF (pH 5.5): 9.76
ACD/KOC (pH 5.5): 163.64
ACD/LogD (pH 7.4): 1.77
ACD/BCF (pH 7.4): 12.98
ACD/KOC (pH 7.4): 217.80
Polar Surface Area: 88 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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