ChemSpider 2D Image | 3-(~2~H_3_)Methyl-4-(~2~H_3_)pyridinol | C6HD6NO

3-(2H3)Methyl-4-(2H3)pyridinol

  • Molecular FormulaC6HD6NO
  • Average mass115.163 Da
  • Monoisotopic mass115.090424 Da
  • ChemSpider ID111333298
  • Non-standard isotope - Non-standard isotope


More details:






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

3-(2H3)Methyl-4-(2H3)pyridinol [German] [ACD/IUPAC Name]
3-(2H3)Methyl-4-(2H3)pyridinol [ACD/IUPAC Name]
3-(2H3)Méthyl-4-(2H3)pyridinol [French] [ACD/IUPAC Name]
4-Pyridin-2,3,6-d3-ol, 5-(methyl-d3)- [ACD/Index Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 359.1±22.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 62.9±3.0 kJ/mol
Flash Point: 171.0±22.3 °C
Index of Refraction: 1.551
Molar Refractivity: 31.1±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: -0.84
ACD/LogD (pH 5.5): -1.37
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.16
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 33 Å2
Polarizability: 12.3±0.5 10-24cm3
Surface Tension: 46.4±3.0 dyne/cm
Molar Volume: 97.4±3.0 cm3

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