ChemSpider 2D Image | [1-(2-Fluorophenyl)cyclobutyl](1,3,3-trimethyl-6-azabicyclo[3.2.1]oct-6-yl)methanone | C21H28FNO

[1-(2-Fluorophenyl)cyclobutyl](1,3,3-trimethyl-6-azabicyclo[3.2.1]oct-6-yl)methanone

  • Molecular FormulaC21H28FNO
  • Average mass329.452 Da
  • Monoisotopic mass329.215485 Da
  • ChemSpider ID32170772

More details:

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

[1-(2-Fluorophenyl)cyclobutyl](1,3,3-trimethyl-6-azabicyclo[3.2.1]oct-6-yl)methanone [ACD/IUPAC Name]
[1-(2-Fluorophényl)cyclobutyl](1,3,3-triméthyl-6-azabicyclo[3.2.1]oct-6-yl)méthanone [French] [ACD/IUPAC Name]
[1-(2-Fluorphenyl)cyclobutyl](1,3,3-trimethyl-6-azabicyclo[3.2.1]oct-6-yl)methanon [German] [ACD/IUPAC Name]
Methanone, [1-(2-fluorophenyl)cyclobutyl](1,3,3-trimethyl-6-azabicyclo[3.2.1]oct-6-yl)- [ACD/Index 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: 441.3±38.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 69.9±3.0 kJ/mol
Flash Point: 220.7±26.8 °C
Index of Refraction: 1.551
Molar Refractivity: 93.2±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 1
ACD/LogP: 5.26
ACD/LogD (pH 5.5): 4.88
ACD/BCF (pH 5.5): 3024.86
ACD/KOC (pH 5.5): 10791.53
ACD/LogD (pH 7.4): 4.88
ACD/BCF (pH 7.4): 3024.87
ACD/KOC (pH 7.4): 10791.56
Polar Surface Area: 20 Å2
Polarizability: 36.9±0.5 10-24cm3
Surface Tension: 41.5±3.0 dyne/cm
Molar Volume: 292.3±3.0 cm3

Click to predict properties on the Chemicalize site


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