ChemSpider 2D Image | Ethyl 2-[2-phenyl(1-~2~H_1_)propyl](2-~2~H)octanoate | C19H28D2O2

Ethyl 2-[2-phenyl(1-2H1)propyl](2-2H)octanoate

  • Molecular FormulaC19H28D2O2
  • Average mass292.453 Da
  • Monoisotopic mass292.237122 Da
  • ChemSpider ID9510283

  • Non-standard isotope - Non-standard isotope

More details:

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

2-[2-Phényl(1-2H1)propyl](2-2H)octanoate d'éthyle [French] [ACD/IUPAC Name]
Benzenebutanoic-α,β-d2 acid, α-hexyl-γ-methyl-, ethyl ester [ACD/Index Name]
Ethyl 2-[2-phenyl(1-2H1)propyl](2-2H)octanoate [ACD/IUPAC Name]
Ethyl-2-[2-phenyl(1-2H1)propyl](2-2H)octanoat [German] [ACD/IUPAC Name]

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

Density: 0.9±0.1 g/cm3
Boiling Point: 375.1±21.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 62.3±3.0 kJ/mol
Flash Point: 108.8±20.4 °C
Index of Refraction: 1.486
Molar Refractivity: 88.5±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 1
ACD/LogP: 6.65
ACD/LogD (pH 5.5): 6.85
ACD/BCF (pH 5.5): 94179.23
ACD/KOC (pH 5.5): 126455.09
ACD/LogD (pH 7.4): 6.85
ACD/BCF (pH 7.4): 94179.23
ACD/KOC (pH 7.4): 126455.09
Polar Surface Area: 26 Å2
Polarizability: 35.1±0.5 10-24cm3
Surface Tension: 33.5±3.0 dyne/cm
Molar Volume: 308.4±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement