ChemSpider 2D Image | [1-(4-Fluorophenyl)-3,4-dihydro-2(1H)-isoquinolinyl][4-(2-methyl-2-propanyl)phenyl]methanone | C26H26FNO

[1-(4-Fluorophenyl)-3,4-dihydro-2(1H)-isoquinolinyl][4-(2-methyl-2-propanyl)phenyl]methanone

  • Molecular FormulaC26H26FNO
  • Average mass387.489 Da
  • Monoisotopic mass387.199829 Da
  • ChemSpider ID22771941

More details:

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

[1-(4-Fluorophényl)-3,4-dihydro-2(1H)-isoquinoléinyl][4-(2-méthyl-2-propanyl)phényl]méthanone [French] [ACD/IUPAC Name]
[1-(4-Fluorophenyl)-3,4-dihydro-2(1H)-isoquinolinyl][4-(2-methyl-2-propanyl)phenyl]methanone [ACD/IUPAC Name]
[1-(4-Fluorphenyl)-3,4-dihydro-2(1H)-isochinolinyl][4-(2-methyl-2-propanyl)phenyl]methanon [German] [ACD/IUPAC Name]
Methanone, [4-(1,1-dimethylethyl)phenyl][1-(4-fluorophenyl)-3,4-dihydro-2(1H)-isoquinolinyl]- [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: 527.8±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 80.2±3.0 kJ/mol
Flash Point: 273.0±30.1 °C
Index of Refraction: 1.589
Molar Refractivity: 114.5±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 1
ACD/LogP: 5.52
ACD/LogD (pH 5.5): 5.89
ACD/BCF (pH 5.5): 17645.25
ACD/KOC (pH 5.5): 38134.95
ACD/LogD (pH 7.4): 5.89
ACD/BCF (pH 7.4): 17645.25
ACD/KOC (pH 7.4): 38134.95
Polar Surface Area: 20 Å2
Polarizability: 45.4±0.5 10-24cm3
Surface Tension: 43.5±3.0 dyne/cm
Molar Volume: 339.4±3.0 cm3

Click to predict properties on the Chemicalize site


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