ChemSpider 2D Image | D-(2,3,4,5,6-~2~H_5_)Phenylalaninamide | C9H7D5N2O

D-(2,3,4,5,6-2H5)Phenylalaninamide

  • Molecular FormulaC9H7D5N2O
  • Average mass169.235 Da
  • Monoisotopic mass169.126343 Da
  • ChemSpider ID111313743

  • defined stereocentres - 1 of 1 defined stereocentres

    Non-standard isotope - Non-standard isotope

More details:

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

Benzene-2,3,4,5,6-d5-propanamide, α-amino-, (αR)- [ACD/Index Name]
D-(2,3,4,5,6-2H5)Phenylalaninamid [German] [ACD/IUPAC Name]
D-(2,3,4,5,6-2H5)Phenylalaninamide [ACD/IUPAC Name]
D-(2,3,4,5,6-2H5)Phénylalaninamide [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: 356.9±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 60.2±3.0 kJ/mol
Flash Point: 169.7±25.9 °C
Index of Refraction: 1.576
Molar Refractivity: 47.5±0.3 cm3
#H bond acceptors: 3
#H bond donors: 4
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 0.18
ACD/LogD (pH 5.5): -1.29
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.07
ACD/LogD (pH 7.4): 0.01
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 21.14
Polar Surface Area: 69 Å2
Polarizability: 18.8±0.5 10-24cm3
Surface Tension: 51.2±3.0 dyne/cm
Molar Volume: 143.6±3.0 cm3

Click to predict properties on the Chemicalize site


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