ChemSpider 2D Image | N-[1-(4-Chlorophenyl)-3-methyl-1H-pyrazol-5-yl]-2-methyl-3,5-dinitrobenzamide | C18H14ClN5O5

N-[1-(4-Chlorophenyl)-3-methyl-1H-pyrazol-5-yl]-2-methyl-3,5-dinitrobenzamide

  • Molecular FormulaC18H14ClN5O5
  • Average mass415.787 Da
  • Monoisotopic mass415.068359 Da
  • ChemSpider ID31334435

More details:

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

Benzamide, N-[1-(4-chlorophenyl)-3-methyl-1H-pyrazol-5-yl]-2-methyl-3,5-dinitro- [ACD/Index Name]
N-[1-(4-Chlorophenyl)-3-methyl-1H-pyrazol-5-yl]-2-methyl-3,5-dinitrobenzamide [ACD/IUPAC Name]
N-[1-(4-Chlorophényl)-3-méthyl-1H-pyrazol-5-yl]-2-méthyl-3,5-dinitrobenzamide [French] [ACD/IUPAC Name]
N-[1-(4-Chlorphenyl)-3-methyl-1H-pyrazol-5-yl]-2-methyl-3,5-dinitrobenzamid [German] [ACD/IUPAC Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 532.2±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 80.8±3.0 kJ/mol
Flash Point: 275.6±30.1 °C
Index of Refraction: 1.692
Molar Refractivity: 104.3±0.5 cm3
#H bond acceptors: 10
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 4.47
ACD/LogD (pH 5.5): 4.28
ACD/BCF (pH 5.5): 1061.73
ACD/KOC (pH 5.5): 5100.57
ACD/LogD (pH 7.4): 4.28
ACD/BCF (pH 7.4): 1061.66
ACD/KOC (pH 7.4): 5100.22
Polar Surface Area: 139 Å2
Polarizability: 41.4±0.5 10-24cm3
Surface Tension: 63.5±7.0 dyne/cm
Molar Volume: 272.4±7.0 cm3

Click to predict properties on the Chemicalize site


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