ChemSpider 2D Image | 3-Fluoro-1-cyclopentene-1-carbonitrile | C6H6FN

3-Fluoro-1-cyclopentene-1-carbonitrile

  • Molecular FormulaC6H6FN
  • Average mass111.117 Da
  • Monoisotopic mass111.048424 Da
  • ChemSpider ID73339785

More details:






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

1-Cyclopentene-1-carbonitrile, 3-fluoro- [ACD/Index Name]
3-Fluor-1-cyclopenten-1-carbonitril [German] [ACD/IUPAC Name]
3-Fluoro-1-cyclopentene-1-carbonitrile [ACD/IUPAC Name]
3-Fluoro-1-cyclopentène-1-carbonitrile [French] [ACD/IUPAC Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 174.3±40.0 °C at 760 mmHg
Vapour Pressure: 1.2±0.3 mmHg at 25°C
Enthalpy of Vaporization: 41.1±3.0 kJ/mol
Flash Point: 60.7±31.1 °C
Index of Refraction: 1.452
Molar Refractivity: 27.5±0.4 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 0.77
ACD/LogD (pH 5.5): 1.04
ACD/BCF (pH 5.5): 3.64
ACD/KOC (pH 5.5): 87.75
ACD/LogD (pH 7.4): 1.04
ACD/BCF (pH 7.4): 3.64
ACD/KOC (pH 7.4): 87.75
Polar Surface Area: 24 Å2
Polarizability: 10.9±0.5 10-24cm3
Surface Tension: 31.3±5.0 dyne/cm
Molar Volume: 101.9±5.0 cm3

Click to predict properties on the Chemicalize site






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