ChemSpider 2D Image | D-(2,5,5-~2~H_3_)Proline | C5H6D3NO2

D-(2,5,5-2H3)Proline

  • Molecular FormulaC5H6D3NO2
  • Average mass118.149 Da
  • Monoisotopic mass118.082161 Da
  • ChemSpider ID24533784
  • 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

D-(2,5,5-2H3)Prolin [German] [ACD/IUPAC Name]
D-(2,5,5-2H3)Proline [ACD/IUPAC Name]
D-(2,5,5-2H3)Proline [French] [ACD/IUPAC Name]
D-Proline-2,5,5-d3 [ACD/Index Name]
D-Proline-2,5,5-d3

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

Density: 1.2±0.1 g/cm3
Boiling Point: 252.2±33.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 53.9±6.0 kJ/mol
Flash Point: 106.3±25.4 °C
Index of Refraction: 1.487
Molar Refractivity: 27.9±0.3 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: -0.57
ACD/LogD (pH 5.5): -2.76
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.76
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 49 Å2
Polarizability: 11.1±0.5 10-24cm3
Surface Tension: 43.4±3.0 dyne/cm
Molar Volume: 97.0±3.0 cm3

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