ChemSpider 2D Image | Ethyl (3E,5E)-3,5-bis{4-[2-(diethylamino)ethoxy]-3-methoxybenzylidene}-4-oxo-1-piperidinecarboxylate | C36H51N3O7

Ethyl (3E,5E)-3,5-bis{4-[2-(diethylamino)ethoxy]-3-methoxybenzylidene}-4-oxo-1-piperidinecarboxylate

  • Molecular FormulaC36H51N3O7
  • Average mass637.806 Da
  • Monoisotopic mass637.372681 Da
  • ChemSpider ID53609188

  • Double-bond stereo - Double-bond stereo

More details:

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

(3E,5E)-3,5-Bis{4-[2-(diéthylamino)éthoxy]-3-méthoxybenzylidène}-4-oxo-1-pipéridinecarboxylate d'éthyle [French] [ACD/IUPAC Name]
1-Piperidinecarboxylic acid, 3,5-bis[[4-[2-(diethylamino)ethoxy]-3-methoxyphenyl]methylene]-4-oxo-, ethyl ester, (3E,5E)- [ACD/Index Name]
Ethyl (3E,5E)-3,5-bis{4-[2-(diethylamino)ethoxy]-3-methoxybenzylidene}-4-oxo-1-piperidinecarboxylate [ACD/IUPAC Name]
Ethyl-(3E,5E)-3,5-bis{4-[2-(diethylamino)ethoxy]-3-methoxybenzyliden}-4-oxo-1-piperidincarboxylat [German] [ACD/IUPAC 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: 757.8±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 110.4±3.0 kJ/mol
Flash Point: 412.1±32.9 °C
Index of Refraction: 1.572
Molar Refractivity: 184.1±0.3 cm3
#H bond acceptors: 10
#H bond donors: 0
#Freely Rotating Bonds: 18
#Rule of 5 Violations: 3
ACD/LogP: 6.93
ACD/LogD (pH 5.5): 1.20
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.45
ACD/LogD (pH 7.4): 1.42
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 2.42
Polar Surface Area: 90 Å2
Polarizability: 73.0±0.5 10-24cm3
Surface Tension: 46.6±3.0 dyne/cm
Molar Volume: 559.3±3.0 cm3

Click to predict properties on the Chemicalize site


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