ChemSpider 2D Image | 5-(1,3-Benzodioxol-5-yl)-1-(1-piperidinyl)-1,2,5-pentanetrione | C17H19NO5

5-(1,3-Benzodioxol-5-yl)-1-(1-piperidinyl)-1,2,5-pentanetrione

  • Molecular FormulaC17H19NO5
  • Average mass317.336 Da
  • Monoisotopic mass317.126312 Da
  • ChemSpider ID29355676

More details:

Featured data source
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

1,2,5-Pentanetrione, 5-(1,3-benzodioxol-5-yl)-1-(1-piperidinyl)- [ACD/Index Name]
5-(1,3-Benzodioxol-5-yl)-1-(1-piperidinyl)-1,2,5-pentanetrione [ACD/IUPAC Name]
5-(1,3-Benzodioxol-5-yl)-1-(1-pipéridinyl)-1,2,5-pentanetrione [French] [ACD/IUPAC Name]
5-(1,3-Benzodioxol-5-yl)-1-(1-piperidinyl)-1,2,5-pentantrion [German] [ACD/IUPAC Name]
piperodione

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

Density: 1.3±0.1 g/cm3
Boiling Point: 516.8±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 78.9±3.0 kJ/mol
Flash Point: 266.3±32.9 °C
Index of Refraction: 1.572
Molar Refractivity: 80.9±0.3 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 0.71
ACD/LogD (pH 5.5): 1.08
ACD/BCF (pH 5.5): 3.91
ACD/KOC (pH 5.5): 92.32
ACD/LogD (pH 7.4): 1.08
ACD/BCF (pH 7.4): 3.91
ACD/KOC (pH 7.4): 92.32
Polar Surface Area: 73 Å2
Polarizability: 32.1±0.5 10-24cm3
Surface Tension: 53.2±3.0 dyne/cm
Molar Volume: 246.0±3.0 cm3

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