ChemSpider 2D Image | 2-(2,3-Dibromo-4-hydroxy-5-methoxybenzylidene)-1H-indene-1,3(2H)-dione | C17H10Br2O4

2-(2,3-Dibromo-4-hydroxy-5-methoxybenzylidene)-1H-indene-1,3(2H)-dione

  • Molecular FormulaC17H10Br2O4
  • Average mass438.067 Da
  • Monoisotopic mass435.894562 Da
  • ChemSpider ID81306776

More details:






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

1H-Indene-1,3(2H)-dione, 2-[(2,3-dibromo-4-hydroxy-5-methoxyphenyl)methylene]- [ACD/Index Name]
2-(2,3-Dibrom-4-hydroxy-5-methoxybenzyliden)-1H-inden-1,3(2H)-dion [German] [ACD/IUPAC Name]
2-(2,3-Dibromo-4-hydroxy-5-methoxybenzylidene)-1H-indene-1,3(2H)-dione [ACD/IUPAC Name]
2-(2,3-Dibromo-4-hydroxy-5-méthoxybenzylidène)-1H-indène-1,3(2H)-dione [French] [ACD/IUPAC Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.9±0.1 g/cm3
Boiling Point: 548.2±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 85.9±3.0 kJ/mol
Flash Point: 285.3±30.1 °C
Index of Refraction: 1.728
Molar Refractivity: 93.3±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 1
ACD/LogP: 5.61
ACD/LogD (pH 5.5): 4.84
ACD/BCF (pH 5.5): 2736.64
ACD/KOC (pH 5.5): 9784.17
ACD/LogD (pH 7.4): 3.94
ACD/BCF (pH 7.4): 346.39
ACD/KOC (pH 7.4): 1238.43
Polar Surface Area: 64 Å2
Polarizability: 37.0±0.5 10-24cm3
Surface Tension: 69.8±3.0 dyne/cm
Molar Volume: 234.1±3.0 cm3

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