ChemSpider 2D Image | 3-{4-Methoxy-3-[(2,3,5,6-tetrafluorophenoxy)methyl]phenyl}-2,2-oxiranedicarbonitrile | C18H10F4N2O3

3-{4-Methoxy-3-[(2,3,5,6-tetrafluorophenoxy)methyl]phenyl}-2,2-oxiranedicarbonitrile

  • Molecular FormulaC18H10F4N2O3
  • Average mass378.277 Da
  • Monoisotopic mass378.062744 Da
  • ChemSpider ID102513294

More details:

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

2,2-Oxiranedicarbonitrile, 3-[4-methoxy-3-[(2,3,5,6-tetrafluorophenoxy)methyl]phenyl]- [ACD/Index Name]
3-{4-Methoxy-3-[(2,3,5,6-tetrafluorophenoxy)methyl]phenyl}-2,2-oxiranedicarbonitrile [ACD/IUPAC Name]
3-{4-Méthoxy-3-[(2,3,5,6-tétrafluorophénoxy)méthyl]phényl}-2,2-oxiranedicarbonitrile [French] [ACD/IUPAC Name]
3-{4-Methoxy-3-[(2,3,5,6-tetrafluorphenoxy)methyl]phenyl}-2,2-oxirandicarbonitril [German] [ACD/IUPAC 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: 532.4±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 80.8±3.0 kJ/mol
Flash Point: 275.8±30.1 °C
Index of Refraction: 1.566
Molar Refractivity: 82.7±0.4 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 2.71
ACD/LogD (pH 5.5): 3.33
ACD/BCF (pH 5.5): 198.27
ACD/KOC (pH 5.5): 1534.55
ACD/LogD (pH 7.4): 3.33
ACD/BCF (pH 7.4): 198.27
ACD/KOC (pH 7.4): 1534.55
Polar Surface Area: 79 Å2
Polarizability: 32.8±0.5 10-24cm3
Surface Tension: 54.1±5.0 dyne/cm
Molar Volume: 253.8±5.0 cm3

Click to predict properties on the Chemicalize site


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