ChemSpider 2D Image | N-Allyl-N-(2-{(4-fluorobenzyl)[(4-oxo-4H-chromen-3-yl)methyl]amino}-2-oxoethyl)octanamide | C30H35FN2O4

N-Allyl-N-(2-{(4-fluorobenzyl)[(4-oxo-4H-chromen-3-yl)methyl]amino}-2-oxoethyl)octanamide

  • Molecular FormulaC30H35FN2O4
  • Average mass506.608 Da
  • Monoisotopic mass506.258087 Da
  • ChemSpider ID3144510

More details:

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

N-Allyl-N-(2-{(4-fluorbenzyl)[(4-oxo-4H-chromen-3-yl)methyl]amino}-2-oxoethyl)octanamid [German] [ACD/IUPAC Name]
N-Allyl-N-(2-{(4-fluorobenzyl)[(4-oxo-4H-chromen-3-yl)methyl]amino}-2-oxoethyl)octanamide [ACD/IUPAC Name]
N-Allyl-N-(2-{(4-fluorobenzyl)[(4-oxo-4H-chromén-3-yl)méthyl]amino}-2-oxoéthyl)octanamide [French] [ACD/IUPAC Name]
Octanamide, N-[2-[[(4-fluorophenyl)methyl][(4-oxo-4H-1-benzopyran-3-yl)methyl]amino]-2-oxoethyl]-N-2-propen-1-yl- [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: 649.4±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 95.7±3.0 kJ/mol
Flash Point: 346.6±31.5 °C
Index of Refraction: 1.560
Molar Refractivity: 141.0±0.3 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 14
#Rule of 5 Violations: 2
ACD/LogP: 6.38
ACD/LogD (pH 5.5): 5.79
ACD/BCF (pH 5.5): 14885.94
ACD/KOC (pH 5.5): 33764.52
ACD/LogD (pH 7.4): 5.79
ACD/BCF (pH 7.4): 14885.96
ACD/KOC (pH 7.4): 33764.55
Polar Surface Area: 67 Å2
Polarizability: 55.9±0.5 10-24cm3
Surface Tension: 46.1±3.0 dyne/cm
Molar Volume: 436.0±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement