ChemSpider 2D Image | 1-(4-Bromophenyl)(~2~H_3_)ethanone | C8H4D3BrO

1-(4-Bromophenyl)(2H3)ethanone

  • Molecular FormulaC8H4D3BrO
  • Average mass202.063 Da
  • Monoisotopic mass200.986847 Da
  • ChemSpider ID27460296
  • Non-standard isotope - Non-standard isotope


More details:






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

1-(4-Bromophenyl)(2H3)ethanone [ACD/IUPAC Name]
1-(4-Bromophényl)(2H3)éthanone [French] [ACD/IUPAC Name]
1-(4-Bromphenyl)(2H3)ethanon [German] [ACD/IUPAC Name]
Ethanone-2,2,2-d3, 1-(4-bromophenyl)- [ACD/Index Name]
4-(Acetyl-d3)-bromobenzene

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

Density: 1.5±0.1 g/cm3
Boiling Point: 259.9±23.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.5 mmHg at 25°C
Enthalpy of Vaporization: 49.8±3.0 kJ/mol
Flash Point: 94.3±9.9 °C
Index of Refraction: 1.554
Molar Refractivity: 44.0±0.3 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 2.43
ACD/LogD (pH 5.5): 2.41
ACD/BCF (pH 5.5): 39.81
ACD/KOC (pH 5.5): 486.25
ACD/LogD (pH 7.4): 2.41
ACD/BCF (pH 7.4): 39.81
ACD/KOC (pH 7.4): 486.25
Polar Surface Area: 17 Å2
Polarizability: 17.4±0.5 10-24cm3
Surface Tension: 39.1±3.0 dyne/cm
Molar Volume: 137.1±3.0 cm3

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