ChemSpider 2D Image | 3-Oxetanecarbonitrile | C4H5NO

3-Oxetanecarbonitrile

  • Molecular FormulaC4H5NO
  • Average mass83.089 Da
  • Monoisotopic mass83.037117 Da
  • ChemSpider ID27531668

More details:






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

3-Oxetancarbonitril [German] [ACD/IUPAC Name]
3-Oxetanecarbonitrile [ACD/Index Name] [ACD/IUPAC Name]
3-Oxétanecarbonitrile [French] [ACD/IUPAC Name]
1420800-16-3 [RN]
CA-5400
MFCD21848216
OXETANE-3-CARBONITRILE
OXETANE-3-CARBONITRILE|OXETANE-3-CARBONITRILE

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

Density: 1.1±0.1 g/cm3
Boiling Point: 193.8±33.0 °C at 760 mmHg
Vapour Pressure: 0.5±0.4 mmHg at 25°C
Enthalpy of Vaporization: 43.0±3.0 kJ/mol
Flash Point: 77.8±19.3 °C
Index of Refraction: 1.441
Molar Refractivity: 20.2±0.4 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: -1.06
ACD/LogD (pH 5.5): -0.56
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 11.81
ACD/LogD (pH 7.4): -0.56
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 11.81
Polar Surface Area: 33 Å2
Polarizability: 8.0±0.5 10-24cm3
Surface Tension: 36.9±5.0 dyne/cm
Molar Volume: 76.4±5.0 cm3

Click to predict properties on the Chemicalize site






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