ChemSpider 2D Image | 3-Hydroxy-L-(beta,beta-~2~H_2_)tyrosine | C9H9D2NO4

3-Hydroxy-L-(β,β-2H2)tyrosine

  • Molecular FormulaC9H9D2NO4
  • Average mass199.200 Da
  • Monoisotopic mass199.081360 Da
  • ChemSpider ID8012787
  • 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

3-Hydroxy-L-(β,β-2H2)tyrosin [German] [ACD/IUPAC Name]
3-Hydroxy-L-(β,β-2H2)tyrosine [ACD/IUPAC Name]
3-Hydroxy-L-(β,β-2H2)tyrosine [French] [ACD/IUPAC Name]
L-Tyrosine-β,β-d2, 3-hydroxy- [ACD/Index Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 448.4±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 74.5±3.0 kJ/mol
Flash Point: 225.0±28.7 °C
Index of Refraction: 1.655
Molar Refractivity: 49.3±0.3 cm3
#H bond acceptors: 5
#H bond donors: 5
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 1
ACD/LogP: -0.22
ACD/LogD (pH 5.5): -2.68
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.70
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 104 Å2
Polarizability: 19.5±0.5 10-24cm3
Surface Tension: 80.2±3.0 dyne/cm
Molar Volume: 134.3±3.0 cm3

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