ChemSpider 2D Image | N-(1-Benzyl-3-pyrrolidinyl)-4-butyl-N-(4-fluorophenyl)cyclohexanecarboxamide | C28H37FN2O

N-(1-Benzyl-3-pyrrolidinyl)-4-butyl-N-(4-fluorophenyl)cyclohexanecarboxamide

  • Molecular FormulaC28H37FN2O
  • Average mass436.605 Da
  • Monoisotopic mass436.289001 Da
  • ChemSpider ID76116231

More details:

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

Cyclohexanecarboxamide, 4-butyl-N-(4-fluorophenyl)-N-[1-(phenylmethyl)-3-pyrrolidinyl]- [ACD/Index Name]
N-(1-Benzyl-3-pyrrolidinyl)-4-butyl-N-(4-fluorophenyl)cyclohexanecarboxamide [ACD/IUPAC Name]
N-(1-Benzyl-3-pyrrolidinyl)-4-butyl-N-(4-fluorophényl)cyclohexanecarboxamide [French] [ACD/IUPAC Name]
N-(1-Benzyl-3-pyrrolidinyl)-4-butyl-N-(4-fluorphenyl)cyclohexancarboxamid [German] [ACD/IUPAC Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 547.8±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 82.7±3.0 kJ/mol
Flash Point: 285.1±30.1 °C
Index of Refraction: 1.573
Molar Refractivity: 129.3±0.3 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 6.88
ACD/LogD (pH 5.5): 3.70
ACD/BCF (pH 5.5): 100.92
ACD/KOC (pH 5.5): 196.29
ACD/LogD (pH 7.4): 5.41
ACD/BCF (pH 7.4): 5153.08
ACD/KOC (pH 7.4): 10022.84
Polar Surface Area: 24 Å2
Polarizability: 51.2±0.5 10-24cm3
Surface Tension: 45.4±3.0 dyne/cm
Molar Volume: 392.5±3.0 cm3

Click to predict properties on the Chemicalize site


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