ChemSpider 2D Image | (3Z,5Z)-3,5-Bis(2-isopropoxybenzylidene)-1-isopropyl-4-piperidinone | C28H35NO3

(3Z,5Z)-3,5-Bis(2-isopropoxybenzylidene)-1-isopropyl-4-piperidinone

  • Molecular FormulaC28H35NO3
  • Average mass433.582 Da
  • Monoisotopic mass433.261688 Da
  • ChemSpider ID22940660

  • Double-bond stereo - Double-bond stereo

More details:

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

(3Z,5Z)-3,5-Bis(2-isopropoxybenzyliden)-1-isopropyl-4-piperidinon [German] [ACD/IUPAC Name]
(3Z,5Z)-3,5-Bis(2-isopropoxybenzylidene)-1-isopropyl-4-piperidinone [ACD/IUPAC Name]
(3Z,5Z)-3,5-Bis(2-isopropoxybenzylidène)-1-isopropyl-4-pipéridinone [French] [ACD/IUPAC Name]
4-Piperidinone, 3,5-bis[[2-(1-methylethoxy)phenyl]methylene]-1-(1-methylethyl)-, (3Z,5Z)- [ACD/Index Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 585.7±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 87.5±3.0 kJ/mol
Flash Point: 308.0±30.1 °C
Index of Refraction: 1.590
Molar Refractivity: 133.7±0.3 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 8.05
ACD/LogD (pH 5.5): 6.27
ACD/BCF (pH 5.5): 28784.13
ACD/KOC (pH 5.5): 43695.49
ACD/LogD (pH 7.4): 6.59
ACD/BCF (pH 7.4): 60297.68
ACD/KOC (pH 7.4): 91534.35
Polar Surface Area: 39 Å2
Polarizability: 53.0±0.5 10-24cm3
Surface Tension: 43.7±3.0 dyne/cm
Molar Volume: 396.5±3.0 cm3

Click to predict properties on the Chemicalize site


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