ChemSpider 2D Image | N-{[7-(3,6-Dimethyl-2-pyrazinyl)-4-fluoro-2,3-dihydro-1-benzofuran-2-yl]methyl}-2,2-diphenylacetamide | C29H26FN3O2

N-{[7-(3,6-Dimethyl-2-pyrazinyl)-4-fluoro-2,3-dihydro-1-benzofuran-2-yl]methyl}-2,2-diphenylacetamide

  • Molecular FormulaC29H26FN3O2
  • Average mass467.534 Da
  • Monoisotopic mass467.200897 Da
  • ChemSpider ID23046666

More details:

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

Benzeneacetamide, N-[[7-(3,6-dimethyl-2-pyrazinyl)-4-fluoro-2,3-dihydro-2-benzofuranyl]methyl]-α-phenyl- [ACD/Index Name]
N-{[7-(3,6-Dimethyl-2-pyrazinyl)-4-fluor-2,3-dihydro-1-benzofuran-2-yl]methyl}-2,2-diphenylacetamid [German] [ACD/IUPAC Name]
N-{[7-(3,6-Dimethyl-2-pyrazinyl)-4-fluoro-2,3-dihydro-1-benzofuran-2-yl]methyl}-2,2-diphenylacetamide [ACD/IUPAC Name]
N-{[7-(3,6-Diméthyl-2-pyrazinyl)-4-fluoro-2,3-dihydro-1-benzofuran-2-yl]méthyl}-2,2-diphénylacétamide [French] [ACD/IUPAC 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: 657.6±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 96.8±3.0 kJ/mol
Flash Point: 351.5±31.5 °C
Index of Refraction: 1.608
Molar Refractivity: 132.3±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 4.06
ACD/LogD (pH 5.5): 4.78
ACD/BCF (pH 5.5): 2527.63
ACD/KOC (pH 5.5): 9489.68
ACD/LogD (pH 7.4): 4.78
ACD/BCF (pH 7.4): 2527.74
ACD/KOC (pH 7.4): 9490.12
Polar Surface Area: 64 Å2
Polarizability: 52.5±0.5 10-24cm3
Surface Tension: 51.3±3.0 dyne/cm
Molar Volume: 382.6±3.0 cm3

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