ChemSpider 2D Image | 1-Fluoro-3-oxocyclobutanecarbonitrile | C5H4FNO

1-Fluoro-3-oxocyclobutanecarbonitrile

  • Molecular FormulaC5H4FNO
  • Average mass113.090 Da
  • Monoisotopic mass113.027695 Da
  • ChemSpider ID71060165

More details:

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

1-Fluor-3-oxocyclobutancarbonitril [German] [ACD/IUPAC Name]
1-Fluoro-3-oxocyclobutanecarbonitrile [ACD/IUPAC Name]
1-Fluoro-3-oxocyclobutanecarbonitrile [French] [ACD/IUPAC Name]
Cyclobutanecarbonitrile, 1-fluoro-3-oxo- [ACD/Index Name]
1-fluoro-3-oxocyclobutane-1-carbonitrile
2231677-14-6 [RN]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 231.2±40.0 °C at 760 mmHg
Vapour Pressure: 0.1±0.5 mmHg at 25°C
Enthalpy of Vaporization: 46.8±3.0 kJ/mol
Flash Point: 93.6±27.3 °C
Index of Refraction: 1.436
Molar Refractivity: 23.3±0.4 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: -0.83
ACD/LogD (pH 5.5): -0.38
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 14.79
ACD/LogD (pH 7.4): -0.38
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 14.79
Polar Surface Area: 41 Å2
Polarizability: 9.3±0.5 10-24cm3
Surface Tension: 37.4±5.0 dyne/cm
Molar Volume: 89.2±5.0 cm3

Click to predict properties on the Chemicalize site


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