ChemSpider 2D Image | 2,2,6,6-Tetrakis(3,3-dihydroxy-2-propen-1-yl)-3-methylcyclohexanone | C19H28O9

2,2,6,6-Tetrakis(3,3-dihydroxy-2-propen-1-yl)-3-methylcyclohexanone

  • Molecular FormulaC19H28O9
  • Average mass400.420 Da
  • Monoisotopic mass400.173340 Da
  • ChemSpider ID95753500

More details:

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

2,2,6,6-Tetrakis(3,3-dihydroxy-2-propen-1-yl)-3-methylcyclohexanon [German] [ACD/IUPAC Name]
2,2,6,6-Tetrakis(3,3-dihydroxy-2-propen-1-yl)-3-methylcyclohexanone [ACD/IUPAC Name]
2,2,6,6-Tétrakis(3,3-dihydroxy-2-propén-1-yl)-3-méthylcyclohexanone [French] [ACD/IUPAC Name]
Cyclohexanone, 2,2,6,6-tetrakis(3,3-dihydroxy-2-propen-1-yl)-3-methyl- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 745.6±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±5.6 mmHg at 25°C
Enthalpy of Vaporization: 124.1±6.0 kJ/mol
Flash Point: 418.6±29.4 °C
Index of Refraction: 1.607
Molar Refractivity: 100.0±0.3 cm3
#H bond acceptors: 9
#H bond donors: 8
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 2.45
ACD/LogD (pH 5.5): -0.41
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 14.33
ACD/LogD (pH 7.4): -0.41
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 14.11
Polar Surface Area: 179 Å2
Polarizability: 39.7±0.5 10-24cm3
Surface Tension: 66.9±3.0 dyne/cm
Molar Volume: 289.8±3.0 cm3

Click to predict properties on the Chemicalize site


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