ChemSpider 2D Image | 3-Hexyl-4,8-dimethyl-7-[(3-methyl-2-buten-1-yl)oxy]-2H-chromen-2-one | C22H30O3

3-Hexyl-4,8-dimethyl-7-[(3-methyl-2-buten-1-yl)oxy]-2H-chromen-2-one

  • Molecular FormulaC22H30O3
  • Average mass342.472 Da
  • Monoisotopic mass342.219482 Da
  • ChemSpider ID21675312

More details:

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

2H-1-Benzopyran-2-one, 3-hexyl-4,8-dimethyl-7-[(3-methyl-2-buten-1-yl)oxy]- [ACD/Index Name]
3-Hexyl-4,8-dimethyl-7-[(3-methyl-2-buten-1-yl)oxy]-2H-chromen-2-on [German] [ACD/IUPAC Name]
3-Hexyl-4,8-dimethyl-7-[(3-methyl-2-buten-1-yl)oxy]-2H-chromen-2-one [ACD/IUPAC Name]
3-Hexyl-4,8-diméthyl-7-[(3-méthyl-2-butén-1-yl)oxy]-2H-chromén-2-one [French] [ACD/IUPAC Name]
3-hexyl-4,8-dimethyl-7-(3-methylbut-2-enoxy)chromen-2-one
3-hexyl-4,8-dimethyl-7-(3-methylbut-2-enyloxy)chromen-2-one
3-Hexyl-4,8-dimethyl-7-(3-methyl-but-2-enyloxy)-chromen-2-one
3-hexyl-4,8-dimethyl-7-[(3-methylbut-2-en-1-yl)oxy]-2H-chromen-2-one
MFCD03029705

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

    Density: 1.0±0.1 g/cm3
    Boiling Point: 475.9±45.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.2 mmHg at 25°C
    Enthalpy of Vaporization: 73.9±3.0 kJ/mol
    Flash Point: 205.0±23.3 °C
    Index of Refraction: 1.520
    Molar Refractivity: 102.3±0.3 cm3
    #H bond acceptors: 3
    #H bond donors: 0
    #Freely Rotating Bonds: 8
    #Rule of 5 Violations: 1
    ACD/LogP: 7.96
    ACD/LogD (pH 5.5): 7.20
    ACD/BCF (pH 5.5): 175582.83
    ACD/KOC (pH 5.5): 197504.31
    ACD/LogD (pH 7.4): 7.20
    ACD/BCF (pH 7.4): 175582.83
    ACD/KOC (pH 7.4): 197504.31
    Polar Surface Area: 36 Å2
    Polarizability: 40.5±0.5 10-24cm3
    Surface Tension: 35.3±3.0 dyne/cm
    Molar Volume: 336.4±3.0 cm3

    Click to predict properties on the Chemicalize site


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