ChemSpider 2D Image | 1-Benzyl-4-(2,2,3,3-~2~H_4_)piperidinone | C12H11D4NO

1-Benzyl-4-(2,2,3,3-2H4)piperidinone

  • Molecular FormulaC12H11D4NO
  • Average mass193.278 Da
  • Monoisotopic mass193.140472 Da
  • ChemSpider ID31045533

  • Non-standard isotope - Non-standard isotope

More details:

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

1-Benzyl-4-(2,2,3,3-2H4)piperidinon [German] [ACD/IUPAC Name]
1-Benzyl-4-(2,2,3,3-2H4)piperidinone [ACD/IUPAC Name]
1-Benzyl-4-(2,2,3,3-2H4)pipéridinone [French] [ACD/IUPAC Name]
4-Piperidinone-2,2,3,3-d4, 1-(phenylmethyl)- [ACD/Index Name]
88227-09-2 [RN]
N-Benzyl-4-piperidone-d4

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

Density: 1.1±0.1 g/cm3
Boiling Point: 278.5±0.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.5 mmHg at 25°C
Enthalpy of Vaporization: 51.7±3.0 kJ/mol
Flash Point: 130.8±11.9 °C
Index of Refraction: 1.562
Molar Refractivity: 55.9±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 1.19
ACD/LogD (pH 5.5): -0.05
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 4.33
ACD/LogD (pH 7.4): 1.35
ACD/BCF (pH 7.4): 5.74
ACD/KOC (pH 7.4): 109.11
Polar Surface Area: 20 Å2
Polarizability: 22.2±0.5 10-24cm3
Surface Tension: 44.9±3.0 dyne/cm
Molar Volume: 172.3±3.0 cm3

Click to predict properties on the Chemicalize site


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