ChemSpider 2D Image | 4'-Bromo-4-biphenylyl 1-(2,2-dimethylpropanoyl)-4-piperidinecarboxylate | C23H26BrNO3

4'-Bromo-4-biphenylyl 1-(2,2-dimethylpropanoyl)-4-piperidinecarboxylate

  • Molecular FormulaC23H26BrNO3
  • Average mass444.361 Da
  • Monoisotopic mass443.109589 Da
  • ChemSpider ID22554525

More details:

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

1-(2,2-Diméthylpropanoyl)-4-pipéridinecarboxylate de 4'-bromo-4-biphénylyle [French] [ACD/IUPAC Name]
4'-Brom-4-biphenylyl-1-(2,2-dimethylpropanoyl)-4-piperidincarboxylat [German] [ACD/IUPAC Name]
4'-Bromo-4-biphenylyl 1-(2,2-dimethylpropanoyl)-4-piperidinecarboxylate [ACD/IUPAC Name]
4-Piperidinecarboxylic acid, 1-(2,2-dimethyl-1-oxopropyl)-, 4'-bromo[1,1'-biphenyl]-4-yl ester [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 562.8±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 84.6±3.0 kJ/mol
Flash Point: 294.2±30.1 °C
Index of Refraction: 1.572
Molar Refractivity: 112.8±0.3 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 5.45
ACD/LogD (pH 5.5): 5.27
ACD/BCF (pH 5.5): 5925.18
ACD/KOC (pH 5.5): 17461.91
ACD/LogD (pH 7.4): 5.27
ACD/BCF (pH 7.4): 5925.18
ACD/KOC (pH 7.4): 17461.91
Polar Surface Area: 47 Å2
Polarizability: 44.7±0.5 10-24cm3
Surface Tension: 45.2±3.0 dyne/cm
Molar Volume: 342.9±3.0 cm3

Click to predict properties on the Chemicalize site


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