ChemSpider 2D Image | 4-Methyl-3-pentyl-6,7,8,9-tetrahydro-2H-[1]benzofuro[3,2-g]chromen-2-one | C21H24O3

4-Methyl-3-pentyl-6,7,8,9-tetrahydro-2H-[1]benzofuro[3,2-g]chromen-2-one

  • Molecular FormulaC21H24O3
  • Average mass324.414 Da
  • Monoisotopic mass324.172546 Da
  • ChemSpider ID21749786

More details:

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

2H-Benzofuro[3,2-g]-1-benzopyran-2-one, 6,7,8,9-tetrahydro-4-methyl-3-pentyl- [ACD/Index Name]
4-Methyl-3-pentyl-6,7,8,9-tetrahydro-2H-[1]benzofuro[3,2-g]chromen-2-on [German] [ACD/IUPAC Name]
4-Methyl-3-pentyl-6,7,8,9-tetrahydro-2H-[1]benzofuro[3,2-g]chromen-2-one [ACD/IUPAC Name]
4-Méthyl-3-pentyl-6,7,8,9-tétrahydro-2H-[1]benzofuro[3,2-g]chromén-2-one [French] [ACD/IUPAC Name]
4-methyl-3-pentyl-6,7,8,9-tetrahydro-[1]benzofuro[3,2-g]chromen-2-one
4-methyl-3-pentyl-6,7,8,9-tetrahydrobenzo[1,2-d]chromeno[7,6-b]furan-2-one
6-Methyl-7-pentyl-1,2,3,4-tetrahydro-9,11-dioxa-benzo[b]fluoren-8-one
MFCD10040239

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

    Density: 1.1±0.1 g/cm3
    Boiling Point: 489.4±40.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.2 mmHg at 25°C
    Enthalpy of Vaporization: 75.6±3.0 kJ/mol
    Flash Point: 249.8±27.3 °C
    Index of Refraction: 1.581
    Molar Refractivity: 94.6±0.3 cm3
    #H bond acceptors: 3
    #H bond donors: 0
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 1
    ACD/LogP: 7.28
    ACD/LogD (pH 5.5): 7.04
    ACD/BCF (pH 5.5): 131185.86
    ACD/KOC (pH 5.5): 160310.25
    ACD/LogD (pH 7.4): 7.04
    ACD/BCF (pH 7.4): 131185.86
    ACD/KOC (pH 7.4): 160310.25
    Polar Surface Area: 39 Å2
    Polarizability: 37.5±0.5 10-24cm3
    Surface Tension: 42.8±3.0 dyne/cm
    Molar Volume: 283.9±3.0 cm3

    Click to predict properties on the Chemicalize site


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