ChemSpider 2D Image | N-{2-[4-(2-Chloro-6-fluorobenzyl)-1-piperazinyl]-2-oxoethyl}-3-nitrobenzamide | C20H20ClFN4O4

N-{2-[4-(2-Chloro-6-fluorobenzyl)-1-piperazinyl]-2-oxoethyl}-3-nitrobenzamide

  • Molecular FormulaC20H20ClFN4O4
  • Average mass434.849 Da
  • Monoisotopic mass434.115723 Da
  • ChemSpider ID32924534

More details:

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

Benzamide, N-[2-[4-[(2-chloro-6-fluorophenyl)methyl]-1-piperazinyl]-2-oxoethyl]-3-nitro- [ACD/Index Name]
N-{2-[4-(2-Chlor-6-fluorbenzyl)-1-piperazinyl]-2-oxoethyl}-3-nitrobenzamid [German] [ACD/IUPAC Name]
N-{2-[4-(2-Chloro-6-fluorobenzyl)-1-piperazinyl]-2-oxoethyl}-3-nitrobenzamide [ACD/IUPAC Name]
N-{2-[4-(2-Chloro-6-fluorobenzyl)-1-pipérazinyl]-2-oxoéthyl}-3-nitrobenzamide [French] [ACD/IUPAC Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 626.5±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 92.7±3.0 kJ/mol
Flash Point: 332.7±31.5 °C
Index of Refraction: 1.616
Molar Refractivity: 108.6±0.3 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 2.06
ACD/LogD (pH 5.5): 2.43
ACD/BCF (pH 5.5): 40.51
ACD/KOC (pH 5.5): 481.27
ACD/LogD (pH 7.4): 2.46
ACD/BCF (pH 7.4): 43.86
ACD/KOC (pH 7.4): 521.05
Polar Surface Area: 98 Å2
Polarizability: 43.0±0.5 10-24cm3
Surface Tension: 58.9±3.0 dyne/cm
Molar Volume: 310.9±3.0 cm3

Click to predict properties on the Chemicalize site


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