ChemSpider 2D Image | 3,4-Pentadien-1-yn-1-amine | C5H5N

3,4-Pentadien-1-yn-1-amine

  • Molecular FormulaC5H5N
  • Average mass79.100 Da
  • Monoisotopic mass79.042198 Da
  • ChemSpider ID95702104

More details:






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

3,4-Pentadien-1-in-1-amin [German] [ACD/IUPAC Name]
3,4-Pentadien-1-yn-1-amine [ACD/Index Name] [ACD/IUPAC Name]
3,4-Pentadién-1-yn-1-amine [French] [ACD/IUPAC Name]

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

Density: 0.9±0.1 g/cm3
Boiling Point: 153.9±23.0 °C at 760 mmHg
Vapour Pressure: 3.3±0.3 mmHg at 25°C
Enthalpy of Vaporization: 39.1±3.0 kJ/mol
Flash Point: 53.7±19.5 °C
Index of Refraction: 1.488
Molar Refractivity: 26.5±0.3 cm3
#H bond acceptors: 1
#H bond donors: 2
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 1.59
ACD/LogD (pH 5.5): 0.07
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 6.00
ACD/LogD (pH 7.4): 1.35
ACD/BCF (pH 7.4): 5.87
ACD/KOC (pH 7.4): 114.47
Polar Surface Area: 26 Å2
Polarizability: 10.5±0.5 10-24cm3
Surface Tension: 16.7±3.0 dyne/cm
Molar Volume: 91.8±3.0 cm3

Click to predict properties on the Chemicalize site






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