ChemSpider 2D Image | N-Benzyl-N-[(1,1-~2~H_2_)ethyl](1,1-~2~H_2_)ethanamine | C11H13D4N

N-Benzyl-N-[(1,1-2H2)ethyl](1,1-2H2)ethanamine

  • Molecular FormulaC11H13D4N
  • Average mass167.284 Da
  • Monoisotopic mass167.161209 Da
  • ChemSpider ID58779461
  • Non-standard isotope - Non-standard isotope


More details:






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

Benzenemethanamine, N,N-di(ethyl-1,1-d2)- [ACD/Index Name]
N-Benzyl-N-[(1,1-2H2)ethyl](1,1-2H2)ethanamin [German] [ACD/IUPAC Name]
N-Benzyl-N-[(1,1-2H2)ethyl](1,1-2H2)ethanamine [ACD/IUPAC Name]
N-Benzyl-N-[(1,1-2H2)éthyl](1,1-2H2)éthanamine [French] [ACD/IUPAC Name]

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

Density: 0.9±0.1 g/cm3
Boiling Point: 208.3±9.0 °C at 760 mmHg
Vapour Pressure: 0.2±0.4 mmHg at 25°C
Enthalpy of Vaporization: 44.5±3.0 kJ/mol
Flash Point: 72.0±15.6 °C
Index of Refraction: 1.509
Molar Refractivity: 53.4±0.3 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 3.04
ACD/LogD (pH 5.5): -0.41
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.40
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 3.69
Polar Surface Area: 3 Å2
Polarizability: 21.2±0.5 10-24cm3
Surface Tension: 32.9±3.0 dyne/cm
Molar Volume: 179.0±3.0 cm3

Click to predict properties on the Chemicalize site






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