ChemSpider 2D Image | 1-Phenyl-2-(1,1-~2~H_2_)propanone | C9H8D2O

1-Phenyl-2-(1,1-2H2)propanone

  • Molecular FormulaC9H8D2O
  • Average mass136.187 Da
  • Monoisotopic mass136.085724 Da
  • ChemSpider ID62842311

  • Non-standard isotope - Non-standard isotope

More details:

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

1-Phenyl-2-(1,1-2H2)propanon [German] [ACD/IUPAC Name]
1-Phenyl-2-(1,1-2H2)propanone [ACD/IUPAC Name]
1-Phényl-2-(1,1-2H2)propanone [French] [ACD/IUPAC Name]
2-Propanone-1,1-d2, 1-phenyl- [ACD/Index Name]
50848-68-5 [RN]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 214.0±0.0 °C at 760 mmHg
Vapour Pressure: 0.2±0.4 mmHg at 25°C
Enthalpy of Vaporization: 45.0±3.0 kJ/mol
Flash Point: 87.5±7.3 °C
Index of Refraction: 1.507
Molar Refractivity: 40.5±0.3 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 1.44
ACD/LogD (pH 5.5): 1.67
ACD/BCF (pH 5.5): 10.98
ACD/KOC (pH 5.5): 193.48
ACD/LogD (pH 7.4): 1.67
ACD/BCF (pH 7.4): 10.98
ACD/KOC (pH 7.4): 193.48
Polar Surface Area: 17 Å2
Polarizability: 16.0±0.5 10-24cm3
Surface Tension: 34.3±3.0 dyne/cm
Molar Volume: 135.9±3.0 cm3

Click to predict properties on the Chemicalize site


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