ChemSpider 2D Image | (2E)-3-Cyclopropyl-2-fluoroacrylonitrile | C6H6FN

(2E)-3-Cyclopropyl-2-fluoroacrylonitrile

  • Molecular FormulaC6H6FN
  • Average mass111.117 Da
  • Monoisotopic mass111.048424 Da
  • ChemSpider ID102900283

  • Double-bond stereo - Double-bond stereo

More details:

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

(2E)-3-Cyclopropyl-2-fluoracrylonitril [German] [ACD/IUPAC Name]
(2E)-3-Cyclopropyl-2-fluoroacrylonitrile [ACD/IUPAC Name]
(2E)-3-Cyclopropyl-2-fluoroacrylonitrile [French] [ACD/IUPAC Name]
2-Propenenitrile, 3-cyclopropyl-2-fluoro-, (2E)- [ACD/Index Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.3±0.1 g/cm3
Boiling Point: 144.5±15.0 °C at 760 mmHg
Vapour Pressure: 5.1±0.3 mmHg at 25°C
Enthalpy of Vaporization: 38.2±3.0 kJ/mol
Flash Point: 43.4±24.1 °C
Index of Refraction: 1.587
Molar Refractivity: 29.5±0.3 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 0.97
ACD/LogD (pH 5.5): 1.37
ACD/BCF (pH 5.5): 6.42
ACD/KOC (pH 5.5): 131.79
ACD/LogD (pH 7.4): 1.37
ACD/BCF (pH 7.4): 6.42
ACD/KOC (pH 7.4): 131.79
Polar Surface Area: 24 Å2
Polarizability: 11.7±0.5 10-24cm3
Surface Tension: 44.7±3.0 dyne/cm
Molar Volume: 87.8±3.0 cm3

Click to predict properties on the Chemicalize site


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