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Search term: 35013373 (Found by CSID)

ChemSpider 2D Image | 1,5-Anhydro-1-[4,6-dihydroxy-2-(hydroxymethyl)-5-methoxy-10-oxo-9,10-dihydro-9-anthracenyl]hexitol | C22H24O10

1,5-Anhydro-1-[4,6-dihydroxy-2-(hydroxymethyl)-5-methoxy-10-oxo-9,10-dihydro-9-anthracenyl]hexitol

  • Molecular FormulaC22H24O10
  • Average mass448.420 Da
  • Monoisotopic mass448.136932 Da
  • ChemSpider ID35013373

More details:






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

1,5-Anhydro-1-[4,6-dihydroxy-2-(hydroxymethyl)-5-methoxy-10-oxo-9,10-dihydro-9-anthracenyl]hexitol [German] [ACD/IUPAC Name]
1,5-Anhydro-1-[4,6-dihydroxy-2-(hydroxymethyl)-5-methoxy-10-oxo-9,10-dihydro-9-anthracenyl]hexitol [ACD/IUPAC Name]
1,5-Anhydro-1-[4,6-dihydroxy-2-(hydroxyméthyl)-5-méthoxy-10-oxo-9,10-dihydro-9-anthracényl]hexitol [French] [ACD/IUPAC Name]
Hexitol, 1,5-anhydro-1-C-[9,10-dihydro-4,6-dihydroxy-2-(hydroxymethyl)-5-methoxy-10-oxo-9-anthracenyl]- [ACD/Index Name]
2,8-dihydroxy-6-(hydroxymethyl)-1-methoxy-10-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-10H-anthracen-9-one
7-Hydroxy-8-O-methylaloin B

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

Density: 1.6±0.1 g/cm3
Boiling Point: 776.5±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.8 mmHg at 25°C
Enthalpy of Vaporization: 118.5±3.0 kJ/mol
Flash Point: 272.4±26.4 °C
Index of Refraction: 1.715
Molar Refractivity: 109.1±0.3 cm3
#H bond acceptors: 10
#H bond donors: 7
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 2
ACD/LogP: 0.89
ACD/LogD (pH 5.5): 0.93
ACD/BCF (pH 5.5): 3.00
ACD/KOC (pH 5.5): 76.03
ACD/LogD (pH 7.4): 0.55
ACD/BCF (pH 7.4): 1.24
ACD/KOC (pH 7.4): 31.38
Polar Surface Area: 177 Å2
Polarizability: 43.3±0.5 10-24cm3
Surface Tension: 92.2±3.0 dyne/cm
Molar Volume: 277.9±3.0 cm3

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