ChemSpider 2D Image | 1'-(3-Cyano-3,3-diphenylpropyl)(2,2,3,3,4,4,5,5,6,6-~2~H_10_)-1,4'-bipiperidine-4'-carboxamide | C27H24D10N4O

1'-(3-Cyano-3,3-diphenylpropyl)(2,2,3,3,4,4,5,5,6,6-2H10)-1,4'-bipiperidine-4'-carboxamide

  • Molecular FormulaC27H24D10N4O
  • Average mass440.647 Da
  • Monoisotopic mass440.336029 Da
  • ChemSpider ID57530512
  • Non-standard isotope - Non-standard isotope


More details:






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

[1,4'-Bipiperidine-2,2,3,3,4,4,5,5,6,6-d10]-4'-carboxamide, 1'-(3-cyano-3,3-diphenylpropyl)- [ACD/Index Name]
1'-(3-Cyan-3,3-diphenylpropyl)(2,2,3,3,4,4,5,5,6,6-2H10)-1,4'-bipiperidin-4'-carboxamid [German] [ACD/IUPAC Name]
1'-(3-Cyano-3,3-diphenylpropyl)(2,2,3,3,4,4,5,5,6,6-2H10)-1,4'-bipiperidine-4'-carboxamide [ACD/IUPAC Name]
1'-(3-Cyano-3,3-diphénylpropyl)(2,2,3,3,4,4,5,5,6,6-2H10)-1,4'-bipipéridine-4'-carboxamide [French] [ACD/IUPAC Name]
1'-(3-Cyano-3,3-diphenylpropyl)(2,2,3,3,4,4,5,5,6,6-2H10)[1,4'-bipiperidine]-4'-carboxamide
1246815-72-4 [RN]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.2±0.1 g/cm3
Boiling Point: 642.5±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 94.8±3.0 kJ/mol
Flash Point: 342.3±31.5 °C
Index of Refraction: 1.590
Molar Refractivity: 126.3±0.3 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 4.21
ACD/LogD (pH 5.5): 1.82
ACD/BCF (pH 5.5): 4.42
ACD/KOC (pH 5.5): 25.20
ACD/LogD (pH 7.4): 3.53
ACD/BCF (pH 7.4): 226.69
ACD/KOC (pH 7.4): 1292.30
Polar Surface Area: 73 Å2
Polarizability: 50.1±0.5 10-24cm3
Surface Tension: 52.9±3.0 dyne/cm
Molar Volume: 374.2±3.0 cm3

Click to predict properties on the Chemicalize site






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