ChemSpider 2D Image | N-{[(2-Methyl-2-propanyl)oxy]carbonyl}(alpha,beta,beta,2,3,4,5,6-~2~H_8_)phenylalanine | C14H11D8NO4

N-{[(2-Methyl-2-propanyl)oxy]carbonyl}(α,β,β,2,3,4,5,6-2H8)phenylalanine

  • Molecular FormulaC14H11D8NO4
  • Average mass273.354 Da
  • Monoisotopic mass273.181610 Da
  • ChemSpider ID17341032

  • Non-standard isotope - Non-standard isotope

More details:

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

N-{[(2-Methyl-2-propanyl)oxy]carbonyl}(α,β,β,2,3,4,5,6-2H8)phenylalanin [German] [ACD/IUPAC Name]
N-{[(2-Methyl-2-propanyl)oxy]carbonyl}(α,β,β,2,3,4,5,6-2H8)phenylalanine [ACD/IUPAC Name]
N-{[(2-Méthyl-2-propanyl)oxy]carbonyl}(α,β,β,2,3,4,5,6-2H8)phénylalanine [French] [ACD/IUPAC Name]
Phenylalanine-α,β,β,2,3,4,5,6-d8, N-[(1,1-dimethylethoxy)carbonyl]- [ACD/Index Name]
106881-07-6 [RN]
L-Phenyl-2,3,4,5,6-d5-alanine-a,b,b-d3, N-[(1,1-dimethylethoxy)carbonyl]- (9CI)

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.2±0.1 g/cm3
Boiling Point: 426.6±38.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 71.8±3.0 kJ/mol
Flash Point: 211.8±26.8 °C
Index of Refraction: 1.528
Molar Refractivity: 70.5±0.3 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 2.96
ACD/LogD (pH 5.5): 0.60
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 5.71
ACD/LogD (pH 7.4): -0.88
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 76 Å2
Polarizability: 27.9±0.5 10-24cm3
Surface Tension: 44.2±3.0 dyne/cm
Molar Volume: 228.6±3.0 cm3

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