ChemSpider 2D Image | 1-[6-(~2~H_3_)Methyl-3-pyridinyl]ethanone | C8H6D3NO

1-[6-(2H3)Methyl-3-pyridinyl]ethanone

  • Molecular FormulaC8H6D3NO
  • Average mass138.182 Da
  • Monoisotopic mass138.087250 Da
  • ChemSpider ID27460080

  • Non-standard isotope - Non-standard isotope

More details:

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

1-[6-(2H3)Methyl-3-pyridinyl]ethanon [German] [ACD/IUPAC Name]
1-[6-(2H3)Methyl-3-pyridinyl]ethanone [ACD/IUPAC Name]
1-[6-(2H3)Méthyl-3-pyridinyl]éthanone [French] [ACD/IUPAC Name]
Ethanone, 1-[6-(methyl-d3)-3-pyridinyl]- [ACD/Index Name]
3-Acetyl-6-(methyl-d3)-pyridine

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

Density: 1.0±0.1 g/cm3
Boiling Point: 233.6±20.0 °C at 760 mmHg
Vapour Pressure: 0.1±0.5 mmHg at 25°C
Enthalpy of Vaporization: 47.0±3.0 kJ/mol
Flash Point: 103.9±0.0 °C
Index of Refraction: 1.513
Molar Refractivity: 39.2±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 0.93
ACD/LogD (pH 5.5): 0.89
ACD/BCF (pH 5.5): 2.75
ACD/KOC (pH 5.5): 70.87
ACD/LogD (pH 7.4): 0.90
ACD/BCF (pH 7.4): 2.87
ACD/KOC (pH 7.4): 74.02
Polar Surface Area: 30 Å2
Polarizability: 15.5±0.5 10-24cm3
Surface Tension: 38.2±3.0 dyne/cm
Molar Volume: 130.5±3.0 cm3

Click to predict properties on the Chemicalize site


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