ChemSpider 2D Image | (Z)-[8-(3-Fluoropropyl)-3-(4-iodophenyl)-8-azabicyclo[3.2.1]oct-2-ylidene](methoxy)methanol | C18H23FINO2

(Z)-[8-(3-Fluoropropyl)-3-(4-iodophenyl)-8-azabicyclo[3.2.1]oct-2-ylidene](methoxy)methanol

  • Molecular FormulaC18H23FINO2
  • Average mass431.284 Da
  • Monoisotopic mass431.075745 Da
  • ChemSpider ID95639289

More details:

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

(Z)-[8-(3-Fluoropropyl)-3-(4-iodophenyl)-8-azabicyclo[3.2.1]oct-2-ylidene](methoxy)methanol [ACD/IUPAC Name]
(Z)-[8-(3-Fluoropropyl)-3-(4-iodophényl)-8-azabicyclo[3.2.1]oct-2-ylidène](méthoxy)méthanol [French] [ACD/IUPAC Name]
(Z)-[8-(3-Fluorpropyl)-3-(4-iodphenyl)-8-azabicyclo[3.2.1]oct-2-yliden](methoxy)methanol [German] [ACD/IUPAC Name]
Methanol, 1-[8-(3-fluoropropyl)-3-(4-iodophenyl)-8-azabicyclo[3.2.1]oct-2-ylidene]-1-methoxy-, (Z)- [ACD/Index Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 486.0±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 79.2±3.0 kJ/mol
Flash Point: 247.7±28.7 °C
Index of Refraction: 1.590
Molar Refractivity: 97.5±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 4.52
ACD/LogD (pH 5.5): 2.37
ACD/BCF (pH 5.5): 18.57
ACD/KOC (pH 5.5): 123.37
ACD/LogD (pH 7.4): 3.55
ACD/BCF (pH 7.4): 277.60
ACD/KOC (pH 7.4): 1844.56
Polar Surface Area: 33 Å2
Polarizability: 38.7±0.5 10-24cm3
Surface Tension: 44.4±3.0 dyne/cm
Molar Volume: 289.0±3.0 cm3

Click to predict properties on the Chemicalize site


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