ChemSpider 2D Image | 1-(~2~H_5_)Phenyl-3-pyrrolidinone | C10H6D5NO

1-(2H5)Phenyl-3-pyrrolidinone

  • Molecular FormulaC10H6D5NO
  • Average mass166.231 Da
  • Monoisotopic mass166.115448 Da
  • ChemSpider ID58780130

  • Non-standard isotope - Non-standard isotope

More details:

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

1-(2H5)Phenyl-3-pyrrolidinon [German] [ACD/IUPAC Name]
1-(2H5)Phenyl-3-pyrrolidinone [ACD/IUPAC Name]
1-(2H5)Phényl-3-pyrrolidinone [French] [ACD/IUPAC Name]
3-Pyrrolidinone, 1-(phenyl-d5)- [ACD/Index Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 296.9±33.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 53.7±3.0 kJ/mol
Flash Point: 120.5±14.8 °C
Index of Refraction: 1.578
Molar Refractivity: 46.6±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 0.52
ACD/LogD (pH 5.5): 1.00
ACD/BCF (pH 5.5): 3.39
ACD/KOC (pH 5.5): 83.24
ACD/LogD (pH 7.4): 1.00
ACD/BCF (pH 7.4): 3.42
ACD/KOC (pH 7.4): 83.91
Polar Surface Area: 20 Å2
Polarizability: 18.5±0.5 10-24cm3
Surface Tension: 46.0±3.0 dyne/cm
Molar Volume: 140.5±3.0 cm3

Click to predict properties on the Chemicalize site


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