ChemSpider 2D Image | 4-Ethynyl-2,6-difluorobenzonitrile | C9H3F2N

4-Ethynyl-2,6-difluorobenzonitrile

  • Molecular FormulaC9H3F2N
  • Average mass163.124 Da
  • Monoisotopic mass163.023361 Da
  • ChemSpider ID94288431

More details:

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

4-Ethinyl-2,6-difluorbenzonitril [German] [ACD/IUPAC Name]
4-Ethynyl-2,6-difluorobenzonitrile [ACD/IUPAC Name]
4-Éthynyl-2,6-difluorobenzonitrile [French] [ACD/IUPAC Name]
Benzonitrile, 4-ethynyl-2,6-difluoro- [ACD/Index Name]
2380236-60-0 [RN]
MFCD32710778

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

Density: 1.3±0.1 g/cm3
Boiling Point: 224.2±40.0 °C at 760 mmHg
Vapour Pressure: 0.1±0.4 mmHg at 25°C
Enthalpy of Vaporization: 46.1±3.0 kJ/mol
Flash Point: 89.4±27.3 °C
Index of Refraction: 1.519
Molar Refractivity: 38.6±0.4 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 1.58
ACD/LogD (pH 5.5): 2.12
ACD/BCF (pH 5.5): 24.04
ACD/KOC (pH 5.5): 338.90
ACD/LogD (pH 7.4): 2.12
ACD/BCF (pH 7.4): 24.04
ACD/KOC (pH 7.4): 338.90
Polar Surface Area: 24 Å2
Polarizability: 15.3±0.5 10-24cm3
Surface Tension: 42.8±5.0 dyne/cm
Molar Volume: 127.2±5.0 cm3

Click to predict properties on the Chemicalize site


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