ChemSpider 2D Image | N-[2-(2-Fluorophenyl)ethyl]-2-(5-methoxy-4,8,8-trimethyl-2-oxo-9,10-dihydro-2H,8H-pyrano[2,3-f]chromen-3-yl)acetamide | C26H28FNO5

N-[2-(2-Fluorophenyl)ethyl]-2-(5-methoxy-4,8,8-trimethyl-2-oxo-9,10-dihydro-2H,8H-pyrano[2,3-f]chromen-3-yl)acetamide

  • Molecular FormulaC26H28FNO5
  • Average mass453.503 Da
  • Monoisotopic mass453.195160 Da
  • ChemSpider ID21757564

More details:

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

2H,8H-Benzo[1,2-b:3,4-b']dipyran-3-acetamide, N-[2-(2-fluorophenyl)ethyl]-9,10-dihydro-5-methoxy-4,8,8-trimethyl-2-oxo- [ACD/Index Name]
N-[2-(2-Fluorophenyl)ethyl]-2-(5-methoxy-4,8,8-trimethyl-2-oxo-9,10-dihydro-2H,8H-pyrano[2,3-f]chromen-3-yl)acetamide [ACD/IUPAC Name]
N-[2-(2-Fluorophényl)éthyl]-2-(5-méthoxy-4,8,8-triméthyl-2-oxo-9,10-dihydro-2H,8H-pyrano[2,3-f]chromén-3-yl)acétamide [French] [ACD/IUPAC Name]
N-[2-(2-Fluorphenyl)ethyl]-2-(5-methoxy-4,8,8-trimethyl-2-oxo-9,10-dihydro-2H,8H-pyrano[2,3-f]chromen-3-yl)acetamid [German] [ACD/IUPAC Name]
1014408-54-8 [RN]
N-[2-(2-Fluoro-phenyl)-ethyl]-2-(5-methoxy-4,8,8-trimethyl-2-oxo-9,10-dihydro-2H,8H-pyrano[2,3-f]chromen-3-yl)-acetamide
N-[2-(2-fluorophenyl)ethyl]-2-(5-methoxy-4,8,8-trimethyl-2-oxo-9,10-dihydropyrano[2,3-h]chromen-3-yl)acetamide

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

    Density: 1.2±0.1 g/cm3
    Boiling Point: 670.0±55.0 °C at 760 mmHg
    Vapour Pressure: 0.0±2.0 mmHg at 25°C
    Enthalpy of Vaporization: 98.4±3.0 kJ/mol
    Flash Point: 359.0±31.5 °C
    Index of Refraction: 1.559
    Molar Refractivity: 120.9±0.3 cm3
    #H bond acceptors: 6
    #H bond donors: 1
    #Freely Rotating Bonds: 6
    #Rule of 5 Violations: 1
    ACD/LogP: 5.37
    ACD/LogD (pH 5.5): 5.39
    ACD/BCF (pH 5.5): 7358.44
    ACD/KOC (pH 5.5): 20390.90
    ACD/LogD (pH 7.4): 5.39
    ACD/BCF (pH 7.4): 7358.45
    ACD/KOC (pH 7.4): 20390.90
    Polar Surface Area: 74 Å2
    Polarizability: 47.9±0.5 10-24cm3
    Surface Tension: 42.3±3.0 dyne/cm
    Molar Volume: 374.8±3.0 cm3

    Click to predict properties on the Chemicalize site


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