ChemSpider 2D Image | 6-Bromo-7-[bromo(1-ethylcyclopentyl)methyl]-2,3-dihydro-1,4-benzodioxine | C16H20Br2O2

6-Bromo-7-[bromo(1-ethylcyclopentyl)methyl]-2,3-dihydro-1,4-benzodioxine

  • Molecular FormulaC16H20Br2O2
  • Average mass404.137 Da
  • Monoisotopic mass401.983002 Da
  • ChemSpider ID36808065

More details:






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

1,4-Benzodioxin, 6-bromo-7-[bromo(1-ethylcyclopentyl)methyl]-2,3-dihydro- [ACD/Index Name]
6-Brom-7-[brom(1-ethylcyclopentyl)methyl]-2,3-dihydro-1,4-benzodioxin [German] [ACD/IUPAC Name]
6-Bromo-7-[bromo(1-ethylcyclopentyl)methyl]-2,3-dihydro-1,4-benzodioxine [ACD/IUPAC Name]
6-Bromo-7-[bromo(1-éthylcyclopentyl)méthyl]-2,3-dihydro-1,4-benzodioxine [French] [ACD/IUPAC Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 426.4±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 65.5±3.0 kJ/mol
Flash Point: 176.6±27.2 °C
Index of Refraction: 1.584
Molar Refractivity: 87.7±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 1
ACD/LogP: 6.65
ACD/LogD (pH 5.5): 6.14
ACD/BCF (pH 5.5): 27453.83
ACD/KOC (pH 5.5): 52328.30
ACD/LogD (pH 7.4): 6.14
ACD/BCF (pH 7.4): 27453.83
ACD/KOC (pH 7.4): 52328.30
Polar Surface Area: 18 Å2
Polarizability: 34.7±0.5 10-24cm3
Surface Tension: 49.9±3.0 dyne/cm
Molar Volume: 262.1±3.0 cm3

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