ChemSpider 2D Image | (2E)-2-Penten-4-yn-1-imine | C5H5N

(2E)-2-Penten-4-yn-1-imine

  • Molecular FormulaC5H5N
  • Average mass79.100 Da
  • Monoisotopic mass79.042198 Da
  • ChemSpider ID67166151
  • Double-bond stereo - Double-bond stereo


More details:






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

(2E)-2-Penten-4-in-1-imin [German] [ACD/IUPAC Name]
(2E)-2-Penten-4-yn-1-imine [ACD/IUPAC Name]
(2E)-2-Pentén-4-yn-1-imine [French] [ACD/IUPAC Name]
2-Penten-4-yn-1-imine, (2E)- [ACD/Index Name]
pent-2-en-4-yne-imine

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

Density: 0.7±0.1 g/cm3
Boiling Point: 70.0±42.0 °C at 760 mmHg
Vapour Pressure: 142.4±0.1 mmHg at 25°C
Enthalpy of Vaporization: 29.9±3.0 kJ/mol
Flash Point: -3.8±27.9 °C
Index of Refraction: 1.418
Molar Refractivity: 27.3±0.5 cm3
#H bond acceptors: 1
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 0.80
ACD/LogD (pH 5.5): -0.45
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 2.60
ACD/LogD (pH 7.4): 0.89
ACD/BCF (pH 7.4): 2.45
ACD/KOC (pH 7.4): 56.71
Polar Surface Area: 24 Å2
Polarizability: 10.8±0.5 10-24cm3
Surface Tension: 27.1±7.0 dyne/cm
Molar Volume: 108.3±7.0 cm3

Click to predict properties on the Chemicalize site






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