ChemSpider 2D Image | 3-geranyl-4-hydroxy-6-(2-hydroxypropyl)-2-pyrone | C18H26O4

3-geranyl-4-hydroxy-6-(2-hydroxypropyl)-2-pyrone

  • Molecular FormulaC18H26O4
  • Average mass306.397 Da
  • Monoisotopic mass306.183105 Da
  • ChemSpider ID20056964
  • Double-bond stereo - Double-bond stereo


More details:



Featured data source



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

2H-Pyran-2-one, 3-[(2E)-3,7-dimethyl-2,6-octadien-1-yl]-4-hydroxy-6-(2-hydroxypropyl)- [ACD/Index Name]
2H-pyran-2-one, 3-[(2E)-3,7-dimethyl-2,6-octadienyl]-4-hydroxy-6-(2-hydroxypropyl)-
3-(3,7-Dimethyl-octa-2,6-dienyl)-4-hydroxy-6-(2-hydroxy-propyl)-pyran-2-one
3-[(2E)-3,7-Dimethyl-2,6-octadien-1-yl]-4-hydroxy-6-(2-hydroxypropyl)-2H-pyran-2-on [German] [ACD/IUPAC Name]
3-[(2E)-3,7-Dimethyl-2,6-octadien-1-yl]-4-hydroxy-6-(2-hydroxypropyl)-2H-pyran-2-one [ACD/IUPAC Name]
3-[(2E)-3,7-Diméthyl-2,6-octadién-1-yl]-4-hydroxy-6-(2-hydroxypropyl)-2H-pyran-2-one [French] [ACD/IUPAC Name]
3-[(2E)-3,7-Dimethylocta-2,6-dien-1-yl]-4-hydroxy-6-(2-hydroxypropyl)-2H-pyran-2-one
3-geranyl-4-hydroxy-6-(2-hydroxypropyl)-2-pyrone
Aurantiacone

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

Density: 1.1±0.1 g/cm3
Boiling Point: 460.3±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 83.1±6.0 kJ/mol
Flash Point: 159.9±22.2 °C
Index of Refraction: 1.535
Molar Refractivity: 87.2±0.3 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 4.01
ACD/LogD (pH 5.5): 3.39
ACD/BCF (pH 5.5): 186.40
ACD/KOC (pH 5.5): 1182.00
ACD/LogD (pH 7.4): 1.77
ACD/BCF (pH 7.4): 4.47
ACD/KOC (pH 7.4): 28.35
Polar Surface Area: 67 Å2
Polarizability: 34.6±0.5 10-24cm3
Surface Tension: 41.6±3.0 dyne/cm
Molar Volume: 280.0±3.0 cm3

Click to predict properties on the Chemicalize site






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