ChemSpider 2D Image | 1-(~2~H_3_)Methyl-4-piperidinone | C6H8D3NO

1-(2H3)Methyl-4-piperidinone

  • Molecular FormulaC6H8D3NO
  • Average mass116.176 Da
  • Monoisotopic mass116.102898 Da
  • ChemSpider ID48063193

  • Non-standard isotope - Non-standard isotope

More details:

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

1-(2H3)Methyl-4-piperidinon [German] [ACD/IUPAC Name]
1-(2H3)Methyl-4-piperidinone [ACD/IUPAC Name]
1-(2H3)Méthyl-4-pipéridinone [French] [ACD/IUPAC Name]
4-Piperidinone, 1-(methyl-d3)- [ACD/Index Name]
1-(trideuteriomethyl)piperidin-4-one
1794756-24-3 [RN]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 181.5±15.0 °C at 760 mmHg
Vapour Pressure: 0.9±0.3 mmHg at 25°C
Enthalpy of Vaporization: 41.8±3.0 kJ/mol
Flash Point: 60.0±0.0 °C
Index of Refraction: 1.464
Molar Refractivity: 31.5±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: -0.35
ACD/LogD (pH 5.5): -2.61
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.90
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 3.65
Polar Surface Area: 20 Å2
Polarizability: 12.5±0.5 10-24cm3
Surface Tension: 32.5±3.0 dyne/cm
Molar Volume: 114.0±3.0 cm3

Click to predict properties on the Chemicalize site


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