ChemSpider 2D Image | 5-(~2~H_3_)Methyl-2(1H)-(3,4,6-~2~H_3_)pyridinone | C6HD6NO

5-(2H3)Methyl-2(1H)-(3,4,6-2H3)pyridinone

  • Molecular FormulaC6HD6NO
  • Average mass115.163 Da
  • Monoisotopic mass115.090424 Da
  • ChemSpider ID107438502

  • Non-standard isotope - Non-standard isotope

More details:

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

2(1H)-Pyridinone-3,4,6-d3, 5-(methyl-d3)- [ACD/Index Name]
5-(2H3)Methyl-2(1H)-(3,4,6-2H3)pyridinon [German] [ACD/IUPAC Name]
5-(2H3)Methyl-2(1H)-(3,4,6-2H3)pyridinone [ACD/IUPAC Name]
5-(2H3)Méthyl-2(1H)-(3,4,6-2H3)pyridinone [French] [ACD/IUPAC Name]
1093952-04-5 [RN]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 304.2±15.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 54.5±3.0 kJ/mol
Flash Point: 170.6±5.3 °C
Index of Refraction: 1.500
Molar Refractivity: 30.4±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 0.01
ACD/LogD (pH 5.5): 0.02
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 24.45
ACD/LogD (pH 7.4): 0.02
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 24.45
Polar Surface Area: 29 Å2
Polarizability: 12.1±0.5 10-24cm3
Surface Tension: 31.6±3.0 dyne/cm
Molar Volume: 103.6±3.0 cm3

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