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Search term: JEDIDNAAMSRTOV (Found by InChIKey (skeleton match))
ChemSpider 2D Image | (3E)-3-[3-Methoxy-4-(nonyloxy)benzylidene]-1-propyl-4-piperidinone | C25H39NO3

(3E)-3-[3-Methoxy-4-(nonyloxy)benzylidene]-1-propyl-4-piperidinone

  • Molecular FormulaC25H39NO3
  • Average mass401.582 Da
  • Monoisotopic mass401.292999 Da
  • ChemSpider ID32182915

  • Double-bond stereo - Double-bond stereo

More details:

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

(3E)-3-[3-Methoxy-4-(nonyloxy)benzyliden]-1-propyl-4-piperidinon [German] [ACD/IUPAC Name]
(3E)-3-[3-Methoxy-4-(nonyloxy)benzylidene]-1-propyl-4-piperidinone [ACD/IUPAC Name]
(3E)-3-[3-Méthoxy-4-(nonyloxy)benzylidène]-1-propyl-4-pipéridinone [French] [ACD/IUPAC Name]
4-Piperidinone, 3-[[3-methoxy-4-(nonyloxy)phenyl]methylene]-1-propyl-, (3E)- [ACD/Index Name]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 534.8±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 81.1±3.0 kJ/mol
Flash Point: 277.3±30.1 °C
Index of Refraction: 1.527
Molar Refractivity: 121.8±0.3 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 13
#Rule of 5 Violations: 1
ACD/LogP: 7.40
ACD/LogD (pH 5.5): 6.09
ACD/BCF (pH 5.5): 14559.12
ACD/KOC (pH 5.5): 17343.52
ACD/LogD (pH 7.4): 7.04
ACD/BCF (pH 7.4): 129012.83
ACD/KOC (pH 7.4): 153686.25
Polar Surface Area: 39 Å2
Polarizability: 48.3±0.5 10-24cm3
Surface Tension: 38.8±3.0 dyne/cm
Molar Volume: 395.9±3.0 cm3

Click to predict properties on the Chemicalize site


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