ChemSpider 2D Image | 1-(~2~H_3_)Methyl-5-(2-pyridinyl)-2-pyrrolidinone | C10H9D3N2O

1-(2H3)Methyl-5-(2-pyridinyl)-2-pyrrolidinone

  • Molecular FormulaC10H9D3N2O
  • Average mass179.234 Da
  • Monoisotopic mass179.113800 Da
  • ChemSpider ID31043468

  • Non-standard isotope - Non-standard isotope

More details:

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

1-(2H3)Methyl-5-(2-pyridinyl)-2-pyrrolidinon [German] [ACD/IUPAC Name]
1-(2H3)Methyl-5-(2-pyridinyl)-2-pyrrolidinone [ACD/IUPAC Name]
1-(2H3)Méthyl-5-(2-pyridinyl)-2-pyrrolidinone [French] [ACD/IUPAC Name]
2-Pyrrolidinone, 1-(methyl-d3)-5-(2-pyridinyl)- [ACD/Index Name]
(±)-COTININE-D3
66269-66-7 [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: 354.1±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 59.9±3.0 kJ/mol
Flash Point: 167.9±25.9 °C
Index of Refraction: 1.556
Molar Refractivity: 49.4±0.3 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: -0.23
ACD/LogD (pH 5.5): 0.14
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 27.89
ACD/LogD (pH 7.4): 0.17
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 29.41
Polar Surface Area: 33 Å2
Polarizability: 19.6±0.5 10-24cm3
Surface Tension: 45.7±3.0 dyne/cm
Molar Volume: 153.7±3.0 cm3

Click to predict properties on the Chemicalize site


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