ChemSpider 2D Image | 1-Cyclobutene-1-carbonitrile | C5H5N

1-Cyclobutene-1-carbonitrile

  • Molecular FormulaC5H5N
  • Average mass79.100 Da
  • Monoisotopic mass79.042198 Da
  • ChemSpider ID62999256

More details:






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

1-Cyclobuten-1-carbonitril [German] [ACD/IUPAC Name]
1-Cyclobutene-1-carbonitrile [ACD/Index Name] [ACD/IUPAC Name]
1-Cyclobutène-1-carbonitrile [French] [ACD/IUPAC Name]
23519-88-2 [RN]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 148.9±10.0 °C at 760 mmHg
Vapour Pressure: 4.1±0.3 mmHg at 25°C
Enthalpy of Vaporization: 38.6±3.0 kJ/mol
Flash Point: 43.0±11.5 °C
Index of Refraction: 1.488
Molar Refractivity: 22.8±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): 0.93
ACD/BCF (pH 5.5): 3.01
ACD/KOC (pH 5.5): 76.66
ACD/LogD (pH 7.4): 0.93
ACD/BCF (pH 7.4): 3.01
ACD/KOC (pH 7.4): 76.66
Polar Surface Area: 24 Å2
Polarizability: 9.0±0.5 10-24cm3
Surface Tension: 36.2±5.0 dyne/cm
Molar Volume: 79.1±5.0 cm3

Click to predict properties on the Chemicalize site






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