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Search term: 71044326 (Found by CSID)
ChemSpider 2D Image | harzianumnone B | C15H16O5

harzianumnone B

  • Molecular FormulaC15H16O5
  • Average mass276.284 Da
  • Monoisotopic mass276.099762 Da
  • ChemSpider ID71044326

  • defined stereocentres - 5 of 5 defined stereocentres

More details:

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

(1R,2R,4aS,9aR,10R)-1,2,8,10-Tetrahydroxy-6-methyl-1,4a,9a,10-tetrahydro-9(2H)-anthracenon [German] [ACD/IUPAC Name]
(1R,2R,4aS,9aR,10R)-1,2,8,10-Tetrahydroxy-6-methyl-1,4a,9a,10-tetrahydro-9(2H)-anthracenone [ACD/IUPAC Name]
(1R,2R,4aS,9aR,10R)-1,2,8,10-Tétrahydroxy-6-méthyl-1,4a,9a,10-tétrahydro-9(2H)-anthracénone [French] [ACD/IUPAC Name]
9(2H)-Anthracenone, 1,4a,9a,10-tetrahydro-1,2,8,10-tetrahydroxy-6-methyl-, (1R,2R,4aS,9aR,10R)- [ACD/Index Name]
harzianumnone B

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

Density: 1.5±0.1 g/cm3
Boiling Point: 528.0±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 84.5±3.0 kJ/mol
Flash Point: 287.2±26.6 °C
Index of Refraction: 1.697
Molar Refractivity: 70.8±0.3 cm3
#H bond acceptors: 5
#H bond donors: 4
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 1.39
ACD/LogD (pH 5.5): 1.49
ACD/BCF (pH 5.5): 7.91
ACD/KOC (pH 5.5): 152.74
ACD/LogD (pH 7.4): 1.33
ACD/BCF (pH 7.4): 5.47
ACD/KOC (pH 7.4): 105.57
Polar Surface Area: 98 Å2
Polarizability: 28.0±0.5 10-24cm3
Surface Tension: 80.7±3.0 dyne/cm
Molar Volume: 183.7±3.0 cm3

Click to predict properties on the Chemicalize site


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