Found 1 result

Search term: 78435679 (Found by CSID)
ChemSpider 2D Image | 1-Butyl-3,5,8-trihydroxy-9,10-anthraquinone | C18H16O5

1-Butyl-3,5,8-trihydroxy-9,10-anthraquinone

  • Molecular FormulaC18H16O5
  • Average mass312.317 Da
  • Monoisotopic mass312.099762 Da
  • ChemSpider ID78435679

More details:

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

1-Butyl-3,5,8-trihydroxy-9,10-anthrachinon [German] [ACD/IUPAC Name]
1-Butyl-3,5,8-trihydroxy-9,10-anthraquinone [ACD/IUPAC Name]
1-Butyl-3,5,8-trihydroxy-9,10-anthraquinone [French] [ACD/IUPAC Name]
9,10-Anthracenedione, 1-butyl-3,5,8-trihydroxy- [ACD/Index Name]
1,4,6-trihydroxy-8-butyl-9,10-anthraquinone

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

Density: 1.4±0.1 g/cm3
Boiling Point: 550.7±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 86.2±3.0 kJ/mol
Flash Point: 300.9±26.6 °C
Index of Refraction: 1.679
Molar Refractivity: 83.1±0.3 cm3
#H bond acceptors: 5
#H bond donors: 3
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 1
ACD/LogP: 6.51
ACD/LogD (pH 5.5): 5.00
ACD/BCF (pH 5.5): 3615.35
ACD/KOC (pH 5.5): 11946.47
ACD/LogD (pH 7.4): 3.84
ACD/BCF (pH 7.4): 248.89
ACD/KOC (pH 7.4): 822.44
Polar Surface Area: 95 Å2
Polarizability: 33.0±0.5 10-24cm3
Surface Tension: 70.9±3.0 dyne/cm
Molar Volume: 220.2±3.0 cm3

Click to predict properties on the Chemicalize site


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