ChemSpider 2D Image | 2-Ethynyl-5-fluorobenzonitrile | C9H4FN

2-Ethynyl-5-fluorobenzonitrile

  • Molecular FormulaC9H4FN
  • Average mass145.133 Da
  • Monoisotopic mass145.032776 Da
  • ChemSpider ID60738333

More details:

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

2-Ethinyl-5-fluorbenzonitril [German] [ACD/IUPAC Name]
2-Ethynyl-5-fluorobenzonitrile [ACD/IUPAC Name]
2-Éthynyl-5-fluorobenzonitrile [French] [ACD/IUPAC Name]
Benzonitrile, 2-ethynyl-5-fluoro- [ACD/Index Name]
1378823-86-9 [RN]
MFCD18205104

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

Density: 1.2±0.1 g/cm3
Boiling Point: 233.6±30.0 °C at 760 mmHg
Vapour Pressure: 0.1±0.5 mmHg at 25°C
Enthalpy of Vaporization: 47.0±3.0 kJ/mol
Flash Point: 93.3±28.3 °C
Index of Refraction: 1.541
Molar Refractivity: 38.5±0.4 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 1.65
ACD/LogD (pH 5.5): 1.92
ACD/BCF (pH 5.5): 17.00
ACD/KOC (pH 5.5): 264.47
ACD/LogD (pH 7.4): 1.92
ACD/BCF (pH 7.4): 17.00
ACD/KOC (pH 7.4): 264.47
Polar Surface Area: 24 Å2
Polarizability: 15.3±0.5 10-24cm3
Surface Tension: 45.6±5.0 dyne/cm
Molar Volume: 122.4±5.0 cm3

Click to predict properties on the Chemicalize site


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