ChemSpider 2D Image | 1-(4-Chlorophenyl)(2-~2~H_1_)ethanone | C8H6DClO

1-(4-Chlorophenyl)(2-2H1)ethanone

  • Molecular FormulaC8H6DClO
  • Average mass155.600 Da
  • Monoisotopic mass155.024826 Da
  • ChemSpider ID62795285
  • Non-standard isotope - Non-standard isotope


More details:






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

1-(4-Chlorophenyl)(2-2H1)ethanone [ACD/IUPAC Name]
1-(4-Chlorophényl)(2-2H1)éthanone [French] [ACD/IUPAC Name]
1-(4-Chlorphenyl)(2-2H1)ethanon [German] [ACD/IUPAC Name]
Ethanone-2-d, 1-(4-chlorophenyl)- [ACD/Index Name]
853775-01-6 [RN]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 237.7±13.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.5 mmHg at 25°C
Enthalpy of Vaporization: 47.5±3.0 kJ/mol
Flash Point: 107.1±11.0 °C
Index of Refraction: 1.532
Molar Refractivity: 41.2±0.3 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 2.35
ACD/LogD (pH 5.5): 2.30
ACD/BCF (pH 5.5): 33.13
ACD/KOC (pH 5.5): 426.41
ACD/LogD (pH 7.4): 2.30
ACD/BCF (pH 7.4): 33.13
ACD/KOC (pH 7.4): 426.41
Polar Surface Area: 17 Å2
Polarizability: 16.3±0.5 10-24cm3
Surface Tension: 37.2±3.0 dyne/cm
Molar Volume: 132.9±3.0 cm3

Click to predict properties on the Chemicalize site






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