ChemSpider 2D Image | 4-[(~2~H_3_)Methyl(nitroso)amino]-1-(1-oxido-3-pyridinyl)-1-butanol | C10H12D3N3O3

4-[(2H3)Methyl(nitroso)amino]-1-(1-oxido-3-pyridinyl)-1-butanol

  • Molecular FormulaC10H12D3N3O3
  • Average mass228.263 Da
  • Monoisotopic mass228.130173 Da
  • ChemSpider ID58784767

  • Non-standard isotope - Non-standard isotope

More details:

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

3-Pyridinemethanol, α-[3-(methyl-d3nitrosoamino)propyl]-, 1-oxide [ACD/Index Name]
4-[(2H3)Methyl(nitroso)amino]-1-(1-oxido-3-pyridinyl)-1-butanol [German] [ACD/IUPAC Name]
4-[(2H3)Methyl(nitroso)amino]-1-(1-oxido-3-pyridinyl)-1-butanol [ACD/IUPAC Name]
4-[(2H3)Méthyl(nitroso)amino]-1-(1-oxydo-3-pyridinyl)-1-butanol [French] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 542.9±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 86.4±3.0 kJ/mol
Flash Point: 282.2±28.7 °C
Index of Refraction: 1.565
Molar Refractivity: 59.4±0.5 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: -2.50
ACD/LogD (pH 5.5): -1.56
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 3.38
ACD/LogD (pH 7.4): -1.56
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 3.38
Polar Surface Area: 78 Å2
Polarizability: 23.6±0.5 10-24cm3
Surface Tension: 49.2±7.0 dyne/cm
Molar Volume: 182.4±7.0 cm3

Click to predict properties on the Chemicalize site


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