ChemSpider 2D Image | 8-Bromo-4H-1,3-benzodioxine-2-thione | C8H5BrO2S

8-Bromo-4H-1,3-benzodioxine-2-thione

  • Molecular FormulaC8H5BrO2S
  • Average mass245.093 Da
  • Monoisotopic mass243.919357 Da
  • ChemSpider ID45498825

More details:

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

4H-1,3-Benzodioxin-2-thione, 8-bromo- [ACD/Index Name]
8-Brom-4H-1,3-benzodioxin-2-thion [German] [ACD/IUPAC Name]
8-Bromo-4H-1,3-benzodioxine-2-thione [ACD/IUPAC Name]
8-Bromo-4H-1,3-benzodioxine-2-thione [French] [ACD/IUPAC Name]
1784575-84-3 [RN]

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

Density: 1.8±0.1 g/cm3
Boiling Point: 298.4±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 51.7±3.0 kJ/mol
Flash Point: 134.3±30.1 °C
Index of Refraction: 1.704
Molar Refractivity: 52.3±0.4 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 2.99
ACD/LogD (pH 5.5): 3.26
ACD/BCF (pH 5.5): 175.39
ACD/KOC (pH 5.5): 1405.64
ACD/LogD (pH 7.4): 3.26
ACD/BCF (pH 7.4): 175.39
ACD/KOC (pH 7.4): 1405.64
Polar Surface Area: 51 Å2
Polarizability: 20.7±0.5 10-24cm3
Surface Tension: 71.1±5.0 dyne/cm
Molar Volume: 134.6±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement