ChemSpider 2D Image | 5-[4-(Benzyloxy)-3-ethoxyphenyl]-3-hydroxy-4-[(2E)-3-phenyl-2-propenoyl]-1-(3-pyridinylmethyl)-1,5-dihydro-2H-pyrrol-2-one | C34H30N2O5

5-[4-(Benzyloxy)-3-ethoxyphenyl]-3-hydroxy-4-[(2E)-3-phenyl-2-propenoyl]-1-(3-pyridinylmethyl)-1,5-dihydro-2H-pyrrol-2-one

  • Molecular FormulaC34H30N2O5
  • Average mass546.612 Da
  • Monoisotopic mass546.215454 Da
  • ChemSpider ID4837031

  • Double-bond stereo - Double-bond stereo

More details:

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

2H-Pyrrol-2-one, 5-[3-ethoxy-4-(phenylmethoxy)phenyl]-1,5-dihydro-3-hydroxy-4-[(2E)-1-oxo-3-phenyl-2-propen-1-yl]-1-(3-pyridinylmethyl)- [ACD/Index Name]
5-[4-(Benzyloxy)-3-ethoxyphenyl]-3-hydroxy-4-[(2E)-3-phenyl-2-propenoyl]-1-(3-pyridinylmethyl)-1,5-dihydro-2H-pyrrol-2-on [German] [ACD/IUPAC Name]
5-[4-(Benzyloxy)-3-ethoxyphenyl]-3-hydroxy-4-[(2E)-3-phenyl-2-propenoyl]-1-(3-pyridinylmethyl)-1,5-dihydro-2H-pyrrol-2-one [ACD/IUPAC Name]
5-[4-(Benzyloxy)-3-éthoxyphényl]-3-hydroxy-4-[(2E)-3-phényl-2-propenoyl]-1-(3-pyridinylméthyl)-1,5-dihydro-2H-pyrrol-2-one [French] [ACD/IUPAC Name]
5-[4-(Benzyloxy)-3-ethoxyphenyl]-3-hydroxy-4-[(2E)-3-phenylprop-2-enoyl]-1-(pyridin-3-ylmethyl)-1,5-dihydro-2H-pyrrol-2-one

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

Density: 1.3±0.1 g/cm3
Boiling Point: 769.8±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.8 mmHg at 25°C
Enthalpy of Vaporization: 117.6±3.0 kJ/mol
Flash Point: 419.4±32.9 °C
Index of Refraction: 1.666
Molar Refractivity: 157.5±0.3 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 2
ACD/LogP: 5.88
ACD/LogD (pH 5.5): 3.55
ACD/BCF (pH 5.5): 159.62
ACD/KOC (pH 5.5): 632.86
ACD/LogD (pH 7.4): 1.87
ACD/BCF (pH 7.4): 3.29
ACD/KOC (pH 7.4): 13.05
Polar Surface Area: 89 Å2
Polarizability: 62.5±0.5 10-24cm3
Surface Tension: 62.0±3.0 dyne/cm
Molar Volume: 423.6±3.0 cm3

Click to predict properties on the Chemicalize site


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