ChemSpider 2D Image | 2-Oxocyclobutanecarbonitrile | C5H5NO

2-Oxocyclobutanecarbonitrile

  • Molecular FormulaC5H5NO
  • Average mass95.099 Da
  • Monoisotopic mass95.037117 Da
  • ChemSpider ID60679205

More details:

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

2-Oxocyclobutancarbonitril [German] [ACD/IUPAC Name]
2-Oxocyclobutanecarbonitrile [ACD/IUPAC Name]
2-Oxocyclobutanecarbonitrile [French] [ACD/IUPAC Name]
Cyclobutanecarbonitrile, 2-oxo- [ACD/Index Name]
52903-54-5 [RN]
MFCD22666099

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

Density: 1.1±0.1 g/cm3
Boiling Point: 249.1±33.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.5 mmHg at 25°C
Enthalpy of Vaporization: 48.6±3.0 kJ/mol
Flash Point: 104.5±25.4 °C
Index of Refraction: 1.464
Molar Refractivity: 23.2±0.4 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: -1.16
ACD/LogD (pH 5.5):
ACD/BCF (pH 5.5):
ACD/KOC (pH 5.5):
ACD/LogD (pH 7.4):
ACD/BCF (pH 7.4):
ACD/KOC (pH 7.4):
Polar Surface Area: 41 Å2
Polarizability: 9.2±0.5 10-24cm3
Surface Tension: 41.5±5.0 dyne/cm
Molar Volume: 83.9±5.0 cm3

Click to predict properties on the Chemicalize site


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