ChemSpider 2D Image | (2E,4E,8E)-9-(1,3-Benzodioxol-5-yl)-1-(1-piperidinyl)-2,4,8-nonatrien-1-one | C21H25NO3

(2E,4E,8E)-9-(1,3-Benzodioxol-5-yl)-1-(1-piperidinyl)-2,4,8-nonatrien-1-one

  • Molecular FormulaC21H25NO3
  • Average mass339.428 Da
  • Monoisotopic mass339.183441 Da
  • ChemSpider ID120329399

  • Double-bond stereo - Double-bond stereo

More details:

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

(2E,4E,8E)-9-(1,3-Benzodioxol-5-yl)-1-(1-piperidinyl)-2,4,8-nonatrien-1-on [German] [ACD/IUPAC Name]
(2E,4E,8E)-9-(1,3-Benzodioxol-5-yl)-1-(1-piperidinyl)-2,4,8-nonatrien-1-one [ACD/IUPAC Name]
(2E,4E,8E)-9-(1,3-Benzodioxol-5-yl)-1-(1-pipéridinyl)-2,4,8-nonatrién-1-one [French] [ACD/IUPAC Name]
2,4,8-Nonatrien-1-one, 9-(1,3-benzodioxol-5-yl)-1-(1-piperidinyl)-, (2E,4E,8E)- [ACD/Index Name]
(2E,4E,8E)-9-(1,3-benzodioxol-5-yl)-1-piperidin-1-ylnona-2,4,8-trien-1-one
107584-38-3 [RN]
Dehydropipernonaline

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

Density: 1.1±0.1 g/cm3
Boiling Point: 582.2±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 87.0±3.0 kJ/mol
Flash Point: 305.9±30.1 °C
Index of Refraction: 1.598
Molar Refractivity: 100.7±0.3 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 4.16
ACD/LogD (pH 5.5): 3.68
ACD/BCF (pH 5.5): 371.25
ACD/KOC (pH 5.5): 2404.20
ACD/LogD (pH 7.4): 3.68
ACD/BCF (pH 7.4): 371.25
ACD/KOC (pH 7.4): 2404.20
Polar Surface Area: 39 Å2
Polarizability: 39.9±0.5 10-24cm3
Surface Tension: 48.1±3.0 dyne/cm
Molar Volume: 295.1±3.0 cm3

Click to predict properties on the Chemicalize site


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