ChemSpider 2D Image | [1-(1,3-Benzodioxol-5-yl)cyclopropyl][3-(pentafluorophenoxy)-1-azetidinyl]methanone | C20H14F5NO4

[1-(1,3-Benzodioxol-5-yl)cyclopropyl][3-(pentafluorophenoxy)-1-azetidinyl]methanone

  • Molecular FormulaC20H14F5NO4
  • Average mass427.322 Da
  • Monoisotopic mass427.084290 Da
  • ChemSpider ID123098997

More details:

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

[1-(1,3-Benzodioxol-5-yl)cyclopropyl][3-(pentafluorophenoxy)-1-azetidinyl]methanone [ACD/IUPAC Name]
[1-(1,3-Benzodioxol-5-yl)cyclopropyl][3-(pentafluorophénoxy)-1-azétidinyl]méthanone [French] [ACD/IUPAC Name]
[1-(1,3-Benzodioxol-5-yl)cyclopropyl][3-(pentafluorphenoxy)-1-azetidinyl]methanon [German] [ACD/IUPAC Name]
Methanone, [1-(1,3-benzodioxol-5-yl)cyclopropyl][3-(2,3,4,5,6-pentafluorophenoxy)-1-azetidinyl]- [ACD/Index Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 519.9±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 79.3±3.0 kJ/mol
Flash Point: 268.2±30.1 °C
Index of Refraction: 1.594
Molar Refractivity: 90.6±0.3 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 3.12
ACD/LogD (pH 5.5): 3.26
ACD/BCF (pH 5.5): 178.17
ACD/KOC (pH 5.5): 1421.54
ACD/LogD (pH 7.4): 3.26
ACD/BCF (pH 7.4): 178.17
ACD/KOC (pH 7.4): 1421.54
Polar Surface Area: 48 Å2
Polarizability: 35.9±0.5 10-24cm3
Surface Tension: 55.8±3.0 dyne/cm
Molar Volume: 266.9±3.0 cm3

Click to predict properties on the Chemicalize site


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