ChemSpider 2D Image | 3,3-Diphenylpropyl 4-(3-chlorophenyl)-2,6-dimethyl-5-(1-piperazinylcarbonyl)nicotinate | C34H34ClN3O3

3,3-Diphenylpropyl 4-(3-chlorophenyl)-2,6-dimethyl-5-(1-piperazinylcarbonyl)nicotinate

  • Molecular FormulaC34H34ClN3O3
  • Average mass568.105 Da
  • Monoisotopic mass567.228882 Da
  • ChemSpider ID8456872

More details:

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

3,3-Diphenylpropyl 4-(3-chlorophenyl)-2,6-dimethyl-5-(1-piperazinylcarbonyl)nicotinate [ACD/IUPAC Name]
3,3-Diphenylpropyl-4-(3-chlorphenyl)-2,6-dimethyl-5-(1-piperazinylcarbonyl)nicotinat [German] [ACD/IUPAC Name]
3-Pyridinecarboxylic acid, 4-(3-chlorophenyl)-2,6-dimethyl-5-(1-piperazinylcarbonyl)-, 3,3-diphenylpropyl ester [ACD/Index Name]
4-(3-Chlorophényl)-2,6-diméthyl-5-(1-pipérazinylcarbonyl)nicotinate de 3,3-diphénylpropyle [French] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 747.0±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.5 mmHg at 25°C
Enthalpy of Vaporization: 108.9±3.0 kJ/mol
Flash Point: 405.6±32.9 °C
Index of Refraction: 1.608
Molar Refractivity: 162.2±0.3 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 2
ACD/LogP: 5.97
ACD/LogD (pH 5.5): 3.45
ACD/BCF (pH 5.5): 60.92
ACD/KOC (pH 5.5): 125.95
ACD/LogD (pH 7.4): 5.15
ACD/BCF (pH 7.4): 3063.35
ACD/KOC (pH 7.4): 6334.01
Polar Surface Area: 72 Å2
Polarizability: 64.3±0.5 10-24cm3
Surface Tension: 49.7±3.0 dyne/cm
Molar Volume: 469.0±3.0 cm3

Click to predict properties on the Chemicalize site


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