ChemSpider 2D Image | 1-Methyl-3-[(~2~H_4_)-3-pyridinylcarbonyl]-2-pyrrolidinone | C11H8D4N2O2

1-Methyl-3-[(2H4)-3-pyridinylcarbonyl]-2-pyrrolidinone

  • Molecular FormulaC11H8D4N2O2
  • Average mass208.250 Da
  • Monoisotopic mass208.114990 Da
  • ChemSpider ID58784799

  • Non-standard isotope - Non-standard isotope

More details:

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

1-Methyl-3-[(2H4)-3-pyridinylcarbonyl]-2-pyrrolidinon [German] [ACD/IUPAC Name]
1-Methyl-3-[(2H4)-3-pyridinylcarbonyl]-2-pyrrolidinone [ACD/IUPAC Name]
1-Méthyl-3-[(2H4)-3-pyridinylcarbonyl]-2-pyrrolidinone [French] [ACD/IUPAC Name]
2-Pyrrolidinone, 1-methyl-3-(3-pyridinyl-d4-carbonyl)- [ACD/Index Name]
(R,S)-1-Methyl-3-nicotinoylpyrrolidone-d4
764661-22-5 [RN]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 413.8±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 66.7±3.0 kJ/mol
Flash Point: 204.0±25.9 °C
Index of Refraction: 1.569
Molar Refractivity: 54.6±0.3 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: -0.37
ACD/LogD (pH 5.5): 0.04
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 24.93
ACD/LogD (pH 7.4): 0.04
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 25.10
Polar Surface Area: 50 Å2
Polarizability: 21.6±0.5 10-24cm3
Surface Tension: 50.9±3.0 dyne/cm
Molar Volume: 166.5±3.0 cm3

Click to predict properties on the Chemicalize site


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