ChemSpider 2D Image | N-(~2~H_3_)Ethanoyl(2,3,3,3-~2~H_4_)alanine | C5H2D7NO3

N-(2H3)Ethanoyl(2,3,3,3-2H4)alanine

  • Molecular FormulaC5H2D7NO3
  • Average mass138.173 Da
  • Monoisotopic mass138.102173 Da
  • ChemSpider ID24533436

  • Non-standard isotope - Non-standard isotope

More details:

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

Alanine-2,3,3,3-d4, N-(1-oxoethyl-2,2,2-d3)- [ACD/Index Name]
N-(2H3)Ethanoyl(2,3,3,3-2H4)alanin [German] [ACD/IUPAC Name]
N-(2H3)Ethanoyl(2,3,3,3-2H4)alanine [ACD/IUPAC Name]
N-(2H3)Éthanoyl(2,3,3,3-2H4)alanine [French] [ACD/IUPAC Name]
2-acetamidopropionic acid
Ac-DL-Ala-OH
N-Acetyl-d3-DL-alanine-2,3,3,3-d4

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

Density: 1.2±0.1 g/cm3
Boiling Point: 369.7±25.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 67.7±6.0 kJ/mol
Flash Point: 177.4±23.2 °C
Index of Refraction: 1.455
Molar Refractivity: 30.4±0.3 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: -1.07
ACD/LogD (pH 5.5): -3.54
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.97
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 66 Å2
Polarizability: 12.0±0.5 10-24cm3
Surface Tension: 40.9±3.0 dyne/cm
Molar Volume: 112.0±3.0 cm3

Click to predict properties on the Chemicalize site


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