ChemSpider 2D Image | 3-[3,4-Bis(benzyloxy)phenyl]-2-cyano-N-(5-quinolinyl)acrylamide | C33H25N3O3

3-[3,4-Bis(benzyloxy)phenyl]-2-cyano-N-(5-quinolinyl)acrylamide

  • Molecular FormulaC33H25N3O3
  • Average mass511.570 Da
  • Monoisotopic mass511.189606 Da
  • ChemSpider ID3734354

More details:

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

2-Propenamide, 3-[3,4-bis(phenylmethoxy)phenyl]-2-cyano-N-5-quinolinyl- [ACD/Index Name]
3-[3,4-Bis(benzyloxy)phényl]-2-cyano-N-(5-quinoléinyl)acrylamide [French] [ACD/IUPAC Name]
3-[3,4-Bis(benzyloxy)phenyl]-2-cyano-N-(5-quinolinyl)acrylamide [ACD/IUPAC Name]
3-[3,4-Bis(benzyloxy)phenyl]-N-(5-chinolinyl)-2-cyanacrylamid [German] [ACD/IUPAC Name]
3-[3,4-bis(benzyloxy)phenyl]-2-cyano-N-(quinolin-5-yl)prop-2-enamide
474072-60-1 [RN]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 771.5±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 112.3±3.0 kJ/mol
Flash Point: 420.4±32.9 °C
Index of Refraction: 1.701
Molar Refractivity: 154.0±0.3 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 2
ACD/LogP: 6.15
ACD/LogD (pH 5.5): 5.89
ACD/BCF (pH 5.5): 17318.72
ACD/KOC (pH 5.5): 37163.25
ACD/LogD (pH 7.4): 5.90
ACD/BCF (pH 7.4): 17923.55
ACD/KOC (pH 7.4): 38461.13
Polar Surface Area: 84 Å2
Polarizability: 61.1±0.5 10-24cm3
Surface Tension: 60.5±3.0 dyne/cm
Molar Volume: 397.8±3.0 cm3

Click to predict properties on the Chemicalize site


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