ChemSpider 2D Image | (2Z)-5-(1,3-Benzodioxol-5-yl)-1-(1-piperidinyl)-2-penten-1-one | C17H21NO3

(2Z)-5-(1,3-Benzodioxol-5-yl)-1-(1-piperidinyl)-2-penten-1-one

  • Molecular FormulaC17H21NO3
  • Average mass287.353 Da
  • Monoisotopic mass287.152130 Da
  • ChemSpider ID109827904

  • Double-bond stereo - Double-bond stereo

More details:

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

(2Z)-5-(1,3-Benzodioxol-5-yl)-1-(1-piperidinyl)-2-penten-1-on [German] [ACD/IUPAC Name]
(2Z)-5-(1,3-Benzodioxol-5-yl)-1-(1-piperidinyl)-2-penten-1-one [ACD/IUPAC Name]
(2Z)-5-(1,3-Benzodioxol-5-yl)-1-(1-pipéridinyl)-2-pentén-1-one [French] [ACD/IUPAC Name]
2-Penten-1-one, 5-(1,3-benzodioxol-5-yl)-1-(1-piperidinyl)-, (2Z)- [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 489.9±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 75.6±3.0 kJ/mol
Flash Point: 250.1±28.7 °C
Index of Refraction: 1.574
Molar Refractivity: 80.4±0.3 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 3.07
ACD/LogD (pH 5.5): 2.77
ACD/BCF (pH 5.5): 74.61
ACD/KOC (pH 5.5): 762.37
ACD/LogD (pH 7.4): 2.77
ACD/BCF (pH 7.4): 74.61
ACD/KOC (pH 7.4): 762.37
Polar Surface Area: 39 Å2
Polarizability: 31.9±0.5 10-24cm3
Surface Tension: 48.0±3.0 dyne/cm
Molar Volume: 243.8±3.0 cm3

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