ChemSpider 2D Image | urceolatin | C21H12Br2O6

urceolatin

  • Molecular FormulaC21H12Br2O6
  • Average mass520.124 Da
  • Monoisotopic mass517.900024 Da
  • ChemSpider ID27023321

More details:

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

6-Brom-1-(3-brom-4,5-dihydroxybenzyl)phenanthro[4,5-bcd]furan-2,3,5-triol [German] [ACD/IUPAC Name]
6-Bromo-1-(3-bromo-4,5-dihydroxybenzyl)phenanthro[4,5-bcd]furan-2,3,5-triol [ACD/IUPAC Name]
6-Bromo-1-(3-bromo-4,5-dihydroxybenzyl)phénanthro[4,5-bcd]furane-2,3,5-triol [French] [ACD/IUPAC Name]
Phenanthro[4,5-bcd]furan-2,3,5-triol, 6-bromo-1-[(3-bromo-4,5-dihydroxyphenyl)methyl]- [ACD/Index Name]
urceolatin

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

Density: 2.1±0.1 g/cm3
Boiling Point: 706.1±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 107.0±3.0 kJ/mol
Flash Point: 380.9±31.5 °C
Index of Refraction: 1.936
Molar Refractivity: 118.9±0.3 cm3
#H bond acceptors: 6
#H bond donors: 5
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 3
ACD/LogP: 5.54
ACD/LogD (pH 5.5): 4.98
ACD/BCF (pH 5.5): 3565.95
ACD/KOC (pH 5.5): 12110.07
ACD/LogD (pH 7.4): 4.72
ACD/BCF (pH 7.4): 1976.97
ACD/KOC (pH 7.4): 6713.85
Polar Surface Area: 114 Å2
Polarizability: 47.1±0.5 10-24cm3
Surface Tension: 102.2±3.0 dyne/cm
Molar Volume: 248.7±3.0 cm3

Click to predict properties on the Chemicalize site


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