Found 11 results

Search term: MF = 'C_{6}H_{4}D_{3}NO'

ChemSpider 2D Image | 1-(~2~H_3_)Methyl-4(1H)-pyridinone | C6H4D3NO

1-(2H3)Methyl-4(1H)-pyridinone

  • Molecular FormulaC6H4D3NO
  • Average mass112.144 Da
  • Monoisotopic mass112.071594 Da
  • ChemSpider ID58780236
  • Non-standard isotope - Non-standard isotope


More details:






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

1-(2H3)Methyl-4(1H)-pyridinon [German] [ACD/IUPAC Name]
1-(2H3)Methyl-4(1H)-pyridinone [ACD/IUPAC Name]
1-(2H3)Méthyl-4(1H)-pyridinone [French] [ACD/IUPAC Name]
4(1H)-Pyridinone, 1-(methyl-d3)- [ACD/Index Name]
7436-17-1 [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: 175.4±33.0 °C at 760 mmHg
Vapour Pressure: 1.2±0.3 mmHg at 25°C
Enthalpy of Vaporization: 41.2±3.0 kJ/mol
Flash Point: 66.2±14.8 °C
Index of Refraction: 1.522
Molar Refractivity: 30.7±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: -0.57
ACD/LogD (pH 5.5): -0.50
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 12.64
ACD/LogD (pH 7.4): -0.50
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 12.69
Polar Surface Area: 20 Å2
Polarizability: 12.2±0.5 10-24cm3
Surface Tension: 36.6±3.0 dyne/cm
Molar Volume: 100.6±3.0 cm3

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