ChemSpider 2D Image | (3Z,5E)-3,5-Bis{(2Z)-3-[4-(dimethylamino)phenyl]-2-propen-1-ylidene}-1-methyl-4-piperidinone | C28H33N3O

(3Z,5E)-3,5-Bis{(2Z)-3-[4-(dimethylamino)phenyl]-2-propen-1-ylidene}-1-methyl-4-piperidinone

  • Molecular FormulaC28H33N3O
  • Average mass427.581 Da
  • Monoisotopic mass427.262360 Da
  • ChemSpider ID30654090

  • Double-bond stereo - Double-bond stereo

More details:

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

(3Z,5E)-3,5-Bis{(2Z)-3-[4-(dimethylamino)phenyl]-2-propen-1-yliden}-1-methyl-4-piperidinon [German] [ACD/IUPAC Name]
(3Z,5E)-3,5-Bis{(2Z)-3-[4-(dimethylamino)phenyl]-2-propen-1-ylidene}-1-methyl-4-piperidinone [ACD/IUPAC Name]
(3Z,5E)-3,5-Bis{(2Z)-3-[4-(diméthylamino)phényl]-2-propén-1-ylidène}-1-méthyl-4-pipéridinone [French] [ACD/IUPAC Name]
4-Piperidinone, 3,5-bis[(2Z)-3-[4-(dimethylamino)phenyl]-2-propen-1-ylidene]-1-methyl-, (3Z,5E)- [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: 639.5±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 94.4±3.0 kJ/mol
Flash Point: 272.0±23.9 °C
Index of Refraction: 1.723
Molar Refractivity: 143.5±0.3 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 5.95
ACD/LogD (pH 5.5): 5.01
ACD/BCF (pH 5.5): 3137.05
ACD/KOC (pH 5.5): 8813.75
ACD/LogD (pH 7.4): 5.36
ACD/BCF (pH 7.4): 6919.99
ACD/KOC (pH 7.4): 19442.14
Polar Surface Area: 27 Å2
Polarizability: 56.9±0.5 10-24cm3
Surface Tension: 61.1±3.0 dyne/cm
Molar Volume: 362.1±3.0 cm3

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