ChemSpider 2D Image | 1-(3-Bromophenyl)(~2~H_3_)ethanone | C8H4D3BrO

1-(3-Bromophenyl)(2H3)ethanone

  • Molecular FormulaC8H4D3BrO
  • Average mass202.063 Da
  • Monoisotopic mass200.986847 Da
  • ChemSpider ID111332356

  • Non-standard isotope - Non-standard isotope

More details:

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

1-(3-Bromophenyl)(2H3)ethanone [ACD/IUPAC Name]
1-(3-Bromophényl)(2H3)éthanone [French] [ACD/IUPAC Name]
1-(3-Bromphenyl)(2H3)ethanon [German] [ACD/IUPAC Name]
Ethanone-2,2,2-d3, 1-(3-bromophenyl)- [ACD/Index Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 255.2±23.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.5 mmHg at 25°C
Enthalpy of Vaporization: 49.3±3.0 kJ/mol
Flash Point: 90.9±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: 2.58
ACD/LogD (pH 5.5): 2.43
ACD/BCF (pH 5.5): 41.74
ACD/KOC (pH 5.5): 503.03
ACD/LogD (pH 7.4): 2.43
ACD/BCF (pH 7.4): 41.74
ACD/KOC (pH 7.4): 503.03
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

Click to predict properties on the Chemicalize site


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