Hexabromocyclododecane C12H18Br6 structure

C12H18Br6 structure
Molecular Formula C12H18Br6
Average mass 641.695 Da
Density 2.1±0.1 g/cm3
Boiling Point 505.2±50.0 °C at 760 mmHg
Flash Point 249.5±24.8 °C
Molar Refractivity 102.1±0.3 cm3
Polarizability 40.5±0.5 10-24cm3
Surface Tension 47.7±3.0 dyne/cm
Molar Volume 299.0±3.0 cm3

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

Density: 2.1±0.1 g/cm3
Boiling Point: 505.2±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 74.6±3.0 kJ/mol
Flash Point: 249.5±24.8 °C
Index of Refraction: 1.598
Molar Refractivity: 102.1±0.3 cm3
#H bond acceptors: 0
#H bond donors: 0
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 2
ACD/LogP: 6.63
ACD/LogD (pH 5.5): 6.41
ACD/BCF (pH 5.5): 43530.96
ACD/KOC (pH 5.5): 72783.73
ACD/LogD (pH 7.4): 6.41
ACD/BCF (pH 7.4): 43530.96
ACD/KOC (pH 7.4): 72783.73
Polar Surface Area: 0 Å2
Polarizability: 40.5±0.5 10-24cm3
Surface Tension: 47.7±3.0 dyne/cm
Molar Volume: 299.0±3.0 cm3

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