ChemSpider 2D Image | spongiadioxin A | C12H4Br4O3

spongiadioxin A

  • Molecular FormulaC12H4Br4O3
  • Average mass515.774 Da
  • Monoisotopic mass511.689362 Da
  • ChemSpider ID8205079

More details:

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

3,4,6,8-Tetrabrom-1-oxanthrenol [German] [ACD/IUPAC Name]
3,4,6,8-Tetrabromo-1-oxanthrenol [ACD/IUPAC Name]
3,4,6,8-Tétrabromo-1-oxanthrénol [French] [ACD/IUPAC Name]
3,4,6,8-tetrabromooxanthren-1-ol
Dibenzo[b,e][1,4]dioxin-1-ol, 3,4,6,8-tetrabromo- [ACD/Index Name]
spongiadioxin A
3,4,6,8-Tetrabromo-dibenzo[1,4]dioxin-1-ol
329040-77-9 [RN]
CHEMBL185828

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

Density: 2.4±0.1 g/cm3
Boiling Point: 498.9±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 79.6±3.0 kJ/mol
Flash Point: 255.5±28.7 °C
Index of Refraction: 1.738
Molar Refractivity: 85.0±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 2
ACD/LogP: 7.84
ACD/LogD (pH 5.5): 7.11
ACD/BCF (pH 5.5): 144850.39
ACD/KOC (pH 5.5): 168013.31
ACD/LogD (pH 7.4): 6.24
ACD/BCF (pH 7.4): 19793.20
ACD/KOC (pH 7.4): 22958.31
Polar Surface Area: 39 Å2
Polarizability: 33.7±0.5 10-24cm3
Surface Tension: 70.8±3.0 dyne/cm
Molar Volume: 211.3±3.0 cm3

Click to predict properties on the Chemicalize site


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