ChemSpider 2D Image | (10S)-1,6,10-Trihydroxy-2-(hydroxymethyl)-8,10-dimethyl-9(10H)-anthracenone | C17H16O5

(10S)-1,6,10-Trihydroxy-2-(hydroxymethyl)-8,10-dimethyl-9(10H)-anthracenone

  • Molecular FormulaC17H16O5
  • Average mass300.306 Da
  • Monoisotopic mass300.099762 Da
  • ChemSpider ID59701548

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(10S)-1,6,10-Trihydroxy-2-(hydroxymethyl)-8,10-dimethyl-9(10H)-anthracenon [German] [ACD/IUPAC Name]
(10S)-1,6,10-Trihydroxy-2-(hydroxymethyl)-8,10-dimethyl-9(10H)-anthracenone [ACD/IUPAC Name]
(10S)-1,6,10-Trihydroxy-2-(hydroxyméthyl)-8,10-diméthyl-9(10H)-anthracénone [French] [ACD/IUPAC Name]
9(10H)-Anthracenone, 1,6,10-trihydroxy-2-(hydroxymethyl)-8,10-dimethyl-, (10S)- [ACD/Index Name]
WS9761 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: 576.4±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 90.8±3.0 kJ/mol
Flash Point: 316.4±26.6 °C
Index of Refraction: 1.707
Molar Refractivity: 79.8±0.3 cm3
#H bond acceptors: 5
#H bond donors: 4
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 1.71
ACD/LogD (pH 5.5): 2.05
ACD/BCF (pH 5.5): 21.26
ACD/KOC (pH 5.5): 308.62
ACD/LogD (pH 7.4): 1.59
ACD/BCF (pH 7.4): 7.31
ACD/KOC (pH 7.4): 106.09
Polar Surface Area: 98 Å2
Polarizability: 31.6±0.5 10-24cm3
Surface Tension: 77.0±3.0 dyne/cm
Molar Volume: 204.9±3.0 cm3

Click to predict properties on the Chemicalize site


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