ChemSpider 2D Image | (1S)-1-(~2~H_5_)Phenyl-2-(2-pyridinyl)ethanamine | C13H9D5N2

(1S)-1-(2H5)Phenyl-2-(2-pyridinyl)ethanamine

  • Molecular FormulaC13H9D5N2
  • Average mass203.294 Da
  • Monoisotopic mass203.147079 Da
  • ChemSpider ID58784989

  • 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

(1S)-1-(2H5)Phenyl-2-(2-pyridinyl)ethanamin [German] [ACD/IUPAC Name]
(1S)-1-(2H5)Phenyl-2-(2-pyridinyl)ethanamine [ACD/IUPAC Name]
(1S)-1-(2H5)Phényl-2-(2-pyridinyl)éthanamine [French] [ACD/IUPAC Name]
2-Pyridineethanamine, α-(phenyl-d5)-, (αS)- [ACD/Index 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: 307.7±27.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 54.8±3.0 kJ/mol
Flash Point: 160.6±10.8 °C
Index of Refraction: 1.602
Molar Refractivity: 61.9±0.3 cm3
#H bond acceptors: 2
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 1.63
ACD/LogD (pH 5.5): -0.74
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.95
ACD/BCF (pH 7.4): 1.91
ACD/KOC (pH 7.4): 31.06
Polar Surface Area: 39 Å2
Polarizability: 24.5±0.5 10-24cm3
Surface Tension: 49.0±3.0 dyne/cm
Molar Volume: 180.6±3.0 cm3

Click to predict properties on the Chemicalize site


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