ChemSpider 2D Image | (2S)-1-Nitroso-2-(~2~H_5_)azetidinecarboxylic acid | C4HD5N2O3

(2S)-1-Nitroso-2-(2H5)azetidinecarboxylic acid

  • Molecular FormulaC4HD5N2O3
  • Average mass135.133 Da
  • Monoisotopic mass135.069229 Da
  • ChemSpider ID77498370

  • 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

(2S)-1-Nitroso-2-(2H5)azetidincarbonsäure [German] [ACD/IUPAC Name]
(2S)-1-Nitroso-2-(2H5)azetidinecarboxylic acid [ACD/IUPAC Name]
2-Azetidine-2,3,3,4,4-d5-carboxylic acid, 1-nitroso-, (2S)- [ACD/Index Name]
Acide (2S)-1-nitroso-2-(2H5)azétidinecarboxylique [French] [ACD/IUPAC Name]

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

Density: 1.7±0.1 g/cm3
Boiling Point: 401.7±38.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 71.6±6.0 kJ/mol
Flash Point: 196.8±26.8 °C
Index of Refraction: 1.663
Molar Refractivity: 28.0±0.5 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: -1.35
ACD/LogD (pH 5.5): -2.81
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.17
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 70 Å2
Polarizability: 11.1±0.5 10-24cm3
Surface Tension: 78.6±7.0 dyne/cm
Molar Volume: 75.5±7.0 cm3

Click to predict properties on the Chemicalize site


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