ChemSpider 2D Image | Curcolone | C15H18O3

Curcolone

  • Molecular FormulaC15H18O3
  • Average mass246.302 Da
  • Monoisotopic mass246.125595 Da
  • ChemSpider ID58802333

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(8S,8aS)-8-Hydroxy-3,5,8a-trimethyl-7,8,8a,9-tetrahydronaphtho[2,3-b]furan-4(6H)-on [German] [ACD/IUPAC Name]
(8S,8aS)-8-Hydroxy-3,5,8a-trimethyl-7,8,8a,9-tetrahydronaphtho[2,3-b]furan-4(6H)-one [ACD/IUPAC Name]
(8S,8aS)-8-Hydroxy-3,5,8a-triméthyl-7,8,8a,9-tétrahydronaphto[2,3-b]furan-4(6H)-one [French] [ACD/IUPAC Name]
17015-43-9 [RN]
Curcolone
Naphtho[2,3-b]furan-4(6H)-one, 7,8,8a,9-tetrahydro-8-hydroxy-3,5,8a-trimethyl-, (8S,8aS)- [ACD/Index Name]
(8S,8aS)-8-hydroxy-3,5,8a-trimethyl-6,7,8,9-tetrahydrobenzo[f][1]benzofuran-4-one

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

    Density: 1.2±0.1 g/cm3
    Boiling Point: 397.5±42.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.0 mmHg at 25°C
    Enthalpy of Vaporization: 68.3±3.0 kJ/mol
    Flash Point: 194.2±27.9 °C
    Index of Refraction: 1.576
    Molar Refractivity: 67.2±0.4 cm3
    #H bond acceptors: 3
    #H bond donors: 1
    #Freely Rotating Bonds: 0
    #Rule of 5 Violations: 0
    ACD/LogP: 2.87
    ACD/LogD (pH 5.5): 2.98
    ACD/BCF (pH 5.5): 108.30
    ACD/KOC (pH 5.5): 995.38
    ACD/LogD (pH 7.4): 2.98
    ACD/BCF (pH 7.4): 108.30
    ACD/KOC (pH 7.4): 995.38
    Polar Surface Area: 50 Å2
    Polarizability: 26.6±0.5 10-24cm3
    Surface Tension: 47.8±5.0 dyne/cm
    Molar Volume: 202.9±5.0 cm3

    Click to predict properties on the Chemicalize site


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