ChemSpider 2D Image | DL-Histidine-α,β,β-d3 | C6H6D3N3O2

DL-Histidine-α,β,β-d3

  • Molecular FormulaC6H6D3N3O2
  • Average mass158.173 Da
  • Monoisotopic mass158.088303 Da
  • ChemSpider ID24532630
  • Non-standard isotope - Non-standard isotope


More details:






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

(α,β,β-2H3)Histidin [German] [ACD/IUPAC Name]
(α,β,β-2H3)Histidine [ACD/IUPAC Name]
(α,β,β-2H3)Histidine [French] [ACD/IUPAC Name]
344299-50-9 [RN]
DL-Histidine-α,β,β-d3
Histidine-α,β,β-d3 [ACD/Index Name]
(?)-a-Amino-?-(4-imidazoyl)propionic Acid, H-DL-His-OH
DL-Histidine-??,??,??-d3
DL-Histidine-α,β,β-d3

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

Density: 1.4±0.1 g/cm3
Boiling Point: 458.9±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 75.8±3.0 kJ/mol
Flash Point: 231.3±25.9 °C
Index of Refraction: 1.615
Molar Refractivity: 38.0±0.3 cm3
#H bond acceptors: 5
#H bond donors: 4
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: -1.26
ACD/LogD (pH 5.5): -3.77
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.08
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 92 Å2
Polarizability: 15.1±0.5 10-24cm3
Surface Tension: 79.7±3.0 dyne/cm
Molar Volume: 109.0±3.0 cm3

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