ChemSpider 2D Image | Methyl phenyl(~2~H_2_)acetate | C9H8D2O2

Methyl phenyl(2H2)acetate

  • Molecular FormulaC9H8D2O2
  • Average mass152.187 Da
  • Monoisotopic mass152.080627 Da
  • ChemSpider ID128918357

  • Non-standard isotope - Non-standard isotope

More details:

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

Benzeneacetic-d2 acid, methyl ester [ACD/Index Name]
Methyl phenyl(2H2)acetate [ACD/IUPAC Name]
Methyl-phenyl(2H2)acetat [German] [ACD/IUPAC Name]
Phényl(2H2)acétate de méthyle [French] [ACD/IUPAC Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 218.0±0.0 °C at 760 mmHg
Vapour Pressure: 0.1±0.4 mmHg at 25°C
Enthalpy of Vaporization: 45.4±3.0 kJ/mol
Flash Point: 90.6±0.0 °C
Index of Refraction: 1.505
Molar Refractivity: 42.2±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 1.97
ACD/LogD (pH 5.5): 1.98
ACD/BCF (pH 5.5): 18.87
ACD/KOC (pH 5.5): 284.95
ACD/LogD (pH 7.4): 1.98
ACD/BCF (pH 7.4): 18.87
ACD/KOC (pH 7.4): 284.95
Polar Surface Area: 26 Å2
Polarizability: 16.7±0.5 10-24cm3
Surface Tension: 36.0±3.0 dyne/cm
Molar Volume: 142.2±3.0 cm3

Click to predict properties on the Chemicalize site


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