ChemSpider 2D Image | alokicenone F | C16H16O5

alokicenone F

  • Molecular FormulaC16H16O5
  • Average mass288.295 Da
  • Monoisotopic mass288.099762 Da
  • ChemSpider ID71048811

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(2S,4S)-2,4,9-Trihydroxy-6-methoxy-8-methyl-3,4-dihydro-1(2H)-anthracenon [German] [ACD/IUPAC Name]
(2S,4S)-2,4,9-Trihydroxy-6-methoxy-8-methyl-3,4-dihydro-1(2H)-anthracenone [ACD/IUPAC Name]
(2S,4S)-2,4,9-Trihydroxy-6-méthoxy-8-méthyl-3,4-dihydro-1(2H)-anthracénone [French] [ACD/IUPAC Name]
1(2H)-Anthracenone, 3,4-dihydro-2,4,9-trihydroxy-6-methoxy-8-methyl-, (2S,4S)- [ACD/Index Name]
alokicenone F

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

Density: 1.4±0.1 g/cm3
Boiling Point: 571.7±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 90.2±3.0 kJ/mol
Flash Point: 217.6±23.6 °C
Index of Refraction: 1.705
Molar Refractivity: 77.6±0.3 cm3
#H bond acceptors: 5
#H bond donors: 3
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 2.01
ACD/LogD (pH 5.5): 2.21
ACD/BCF (pH 5.5): 27.96
ACD/KOC (pH 5.5): 375.50
ACD/LogD (pH 7.4): 1.81
ACD/BCF (pH 7.4): 11.11
ACD/KOC (pH 7.4): 149.29
Polar Surface Area: 87 Å2
Polarizability: 30.8±0.5 10-24cm3
Surface Tension: 73.7±3.0 dyne/cm
Molar Volume: 199.6±3.0 cm3

Click to predict properties on the Chemicalize site


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