ChemSpider 2D Image | 5-Bromo(2,2-~2~H_2_)-1,3-benzodioxole | C7H3D2BrO2

5-Bromo(2,2-2H2)-1,3-benzodioxole

  • Molecular FormulaC7H3D2BrO2
  • Average mass203.030 Da
  • Monoisotopic mass201.959839 Da
  • ChemSpider ID27460430

  • Non-standard isotope - Non-standard isotope

More details:

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

1,3-Benzodioxole-2,2-d2, 5-bromo- [ACD/Index Name]
5-Brom(2,2-2H2)-1,3-benzodioxol [German] [ACD/IUPAC Name]
5-Bromo(2,2-2H2)-1,3-benzodioxole [ACD/IUPAC Name]
5-Bromo(2,2-2H2)-1,3-benzodioxole [French] [ACD/IUPAC Name]
1-Bromo-3,4-(methylenedioxy-d2)-benzene

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

Density: 1.7±0.1 g/cm3
Boiling Point: 268.6±0.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.5 mmHg at 25°C
Enthalpy of Vaporization: 48.6±3.0 kJ/mol
Flash Point: 107.5±19.8 °C
Index of Refraction: 1.603
Molar Refractivity: 40.1±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 2.98
ACD/LogD (pH 5.5): 2.64
ACD/BCF (pH 5.5): 59.64
ACD/KOC (pH 5.5): 649.45
ACD/LogD (pH 7.4): 2.64
ACD/BCF (pH 7.4): 59.64
ACD/KOC (pH 7.4): 649.45
Polar Surface Area: 18 Å2
Polarizability: 15.9±0.5 10-24cm3
Surface Tension: 51.7±3.0 dyne/cm
Molar Volume: 116.8±3.0 cm3

Click to predict properties on the Chemicalize site


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