ChemSpider 2D Image | 2-Oxo-3-pentenenitrile | C5H5NO

2-Oxo-3-pentenenitrile

  • Molecular FormulaC5H5NO
  • Average mass95.099 Da
  • Monoisotopic mass95.037117 Da
  • ChemSpider ID57541294

More details:

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

2-Oxo-3-pentenenitrile [ACD/IUPAC Name]
2-Oxo-3-pentènenitrile [French] [ACD/IUPAC Name]
2-Oxo-3-pentennitril [German] [ACD/IUPAC Name]
3-pentenenitrile, 2-oxo- [ACD/Index Name]
38576-57-7 [RN]
6047-88-7 [RN]
But-2-enoyl cyanide

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

Density: 1.0±0.1 g/cm3
Boiling Point: 133.8±13.0 °C at 760 mmHg
Vapour Pressure: 8.3±0.2 mmHg at 25°C
Enthalpy of Vaporization: 37.1±3.0 kJ/mol
Flash Point: 34.7±19.8 °C
Index of Refraction: 1.443
Molar Refractivity: 25.2±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 0.41
ACD/LogD (pH 5.5): 0.38
ACD/BCF (pH 5.5): 1.14
ACD/KOC (pH 5.5): 38.13
ACD/LogD (pH 7.4): 0.38
ACD/BCF (pH 7.4): 1.14
ACD/KOC (pH 7.4): 38.13
Polar Surface Area: 41 Å2
Polarizability: 10.0±0.5 10-24cm3
Surface Tension: 35.1±3.0 dyne/cm
Molar Volume: 95.2±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement