ChemSpider 2D Image | 1-Phenyl(2,2,2-~2~H_3_)ethan(~2~H)ol | C8H6D4O

1-Phenyl(2,2,2-2H3)ethan(2H)ol

  • Molecular FormulaC8H6D4O
  • Average mass126.189 Da
  • Monoisotopic mass126.098274 Da
  • ChemSpider ID74146495

  • Non-standard isotope - Non-standard isotope

More details:

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

1-Phenyl(2,2,2-2H3)ethan(2H)ol [German] [ACD/IUPAC Name]
1-Phenyl(2,2,2-2H3)ethan(2H)ol [ACD/IUPAC Name]
1-Phényl(2,2,2-2H3)éthan(2H)ol [French] [ACD/IUPAC Name]
Benzenemethanol-d, α-(methyl-d3)- [ACD/Index Name]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 206.9±8.0 °C at 760 mmHg
Vapour Pressure: 0.1±0.4 mmHg at 25°C
Enthalpy of Vaporization: 46.8±3.0 kJ/mol
Flash Point: 85.0±0.0 °C
Index of Refraction: 1.532
Molar Refractivity: 37.3±0.3 cm3
#H bond acceptors: 1
#H bond donors: 1
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 1.38
ACD/LogD (pH 5.5): 1.45
ACD/BCF (pH 5.5): 7.38
ACD/KOC (pH 5.5): 145.55
ACD/LogD (pH 7.4): 1.45
ACD/BCF (pH 7.4): 7.38
ACD/KOC (pH 7.4): 145.55
Polar Surface Area: 20 Å2
Polarizability: 14.8±0.5 10-24cm3
Surface Tension: 38.0±3.0 dyne/cm
Molar Volume: 120.5±3.0 cm3

Click to predict properties on the Chemicalize site


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