ChemSpider 2D Image | 4-(2,4-Hexadien-1-yl)-3-(2-hydroxypropyl)-2(5H)-furanone | C13H18O3

4-(2,4-Hexadien-1-yl)-3-(2-hydroxypropyl)-2(5H)-furanone

  • Molecular FormulaC13H18O3
  • Average mass222.280 Da
  • Monoisotopic mass222.125595 Da
  • ChemSpider ID28681723

More details:






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

2(5H)-Furanone, 4-(2,4-hexadien-1-yl)-3-(2-hydroxypropyl)- [ACD/Index Name]
4-(2,4-Hexadien-1-yl)-3-(2-hydroxypropyl)-2(5H)-furanon [German] [ACD/IUPAC Name]
4-(2,4-Hexadien-1-yl)-3-(2-hydroxypropyl)-2(5H)-furanone [ACD/IUPAC Name]
4-(2,4-Hexadién-1-yl)-3-(2-hydroxypropyl)-2(5H)-furanone [French] [ACD/IUPAC Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 395.8±30.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 74.7±6.0 kJ/mol
Flash Point: 168.8±17.3 °C
Index of Refraction: 1.519
Molar Refractivity: 63.2±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 1.55
ACD/LogD (pH 5.5): 2.33
ACD/BCF (pH 5.5): 34.68
ACD/KOC (pH 5.5): 440.57
ACD/LogD (pH 7.4): 2.33
ACD/BCF (pH 7.4): 34.68
ACD/KOC (pH 7.4): 440.57
Polar Surface Area: 47 Å2
Polarizability: 25.1±0.5 10-24cm3
Surface Tension: 37.9±3.0 dyne/cm
Molar Volume: 208.3±3.0 cm3

Click to predict properties on the Chemicalize site






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