ChemSpider 2D Image | N-[3-(3,5-Dimethoxybenzoyl)-4-piperidinyl]-3,5-dinitrobenzamide | C21H22N4O8

N-[3-(3,5-Dimethoxybenzoyl)-4-piperidinyl]-3,5-dinitrobenzamide

  • Molecular FormulaC21H22N4O8
  • Average mass458.421 Da
  • Monoisotopic mass458.143768 Da
  • ChemSpider ID59208519

More details:

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

Benzamide, N-[3-(3,5-dimethoxybenzoyl)-4-piperidinyl]-3,5-dinitro- [ACD/Index Name]
N-[3-(3,5-Dimethoxybenzoyl)-4-piperidinyl]-3,5-dinitrobenzamid [German] [ACD/IUPAC Name]
N-[3-(3,5-Dimethoxybenzoyl)-4-piperidinyl]-3,5-dinitrobenzamide [ACD/IUPAC Name]
N-[3-(3,5-Diméthoxybenzoyl)-4-pipéridinyl]-3,5-dinitrobenzamide [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: 642.7±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 94.9±3.0 kJ/mol
Flash Point: 342.5±31.5 °C
Index of Refraction: 1.627
Molar Refractivity: 114.1±0.4 cm3
#H bond acceptors: 12
#H bond donors: 2
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 2.41
ACD/LogD (pH 5.5): -0.58
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.98
ACD/BCF (pH 7.4): 1.64
ACD/KOC (pH 7.4): 21.77
Polar Surface Area: 168 Å2
Polarizability: 45.2±0.5 10-24cm3
Surface Tension: 67.4±5.0 dyne/cm
Molar Volume: 322.0±5.0 cm3

Click to predict properties on the Chemicalize site


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